K204-0006 Screening compound: 1-(4-{N'-[(Z)-[3a,5a,7-trihydroxy-11a-methyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-9a-yl]methylidene]hydrazinecarbonyl}phenyl)-3-methylurea

K204-0006 Screening compound: 1-(4-{N'-[(Z)-[3a,5a,7-trihydroxy-11a-methyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-9a-yl]methylidene]hydrazinecarbonyl}phenyl)-3-methylurea
K204-0006 Screening compound: 1-(4-{N'-[(Z)-[3a,5a,7-trihydroxy-11a-methyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-9a-yl]methylidene]hydrazinecarbonyl}phenyl)-3-methylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound K204-0006
1-(4-{N'-[(Z)-[3a,5a,7-trihydroxy-11a-methyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-9a-yl]methylidene]hydrazinecarbonyl}phenyl)-3-methylurea

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

K204-0006

Molecular Formula

C32H42N4O7 (C32 H42 N4 O7)

Compound Name

1-(4-{N'-[(Z)-[3a,5a,7-trihydroxy-11a-methyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-9a-yl]methylidene]hydrazinecarbonyl}phenyl)-3-methylurea

IUPAC name

1-(4-{N'-[(Z)-[(3bR7R9bS)-3a5a7-trihydroxy-11a-methyl-1-(5-oxo-25-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-9a-yl]methylidene]hydrazinecarbonyl}phenyl)-3-methylurea

SMILES

CC(CC[C@@H]([C@H]1CCC2(C[C@@H](CC3)O)O)C23/C=N\NC(c(cc2)ccc2NC(NC)=O)=O)(C(CC2)C(CO3)=CC3=O)C12O

InChI

InChI=1S/C32H42N4O7/c1-29-11-8-24-25(32(29,42)14-10-23(29)20-15-26(38)43-17-20)9-13-31(41)16-22(37)7-12-30(24,31)18-34-36-27(39)19-3-5-21(6-4-19)35-28(40)33-2/h3-6,15,18,22-25,37,41-42H,7-14,16-17H2,1-2H3,(H,36,39)(H2,33,35,40)/t22-,23?,24+,25+,29?,30?,31?,32?/m0/s1

InChI Key

PNZGSNYJSGYHLU-VUCXDFMISA-N

MDL Number (MFCD)

MFCD02656705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

594.71

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

6.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.668

Distribution Coefficient, logD

1.667

Water Solubility, LogSw

-3.20

Polar Surface Area

137.631

Acid Dissociation Constant (pKa)

9.99

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

8.00

Percent sp3 carbon bonding

62.50

K204-0006 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Steroid-like Compounds (494 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cardiovascular
  • Metabolic
  • Immune system
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with K204-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K204-0006?
Check Price and Availability of K204-0006, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K204-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K204-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K204-0006
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of K204-0006 available by request