V017-6506 Screening compound: ethyl 2-{[(1-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)carbamoyl]amino}acetate

V017-6506 Screening compound: ethyl 2-{[(1-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)carbamoyl]amino}acetate
V017-6506 Screening compound: ethyl 2-{[(1-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)carbamoyl]amino}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-6506
ethyl 2-{[(1-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)carbamoyl]amino}acetate

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

V017-6506

Molecular Formula

C22H22ClN5O4S (C22 H22 ClN5 O4 S)

Compound Name

ethyl 2-{[(1-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)carbamoyl]amino}acetate

IUPAC name

ethyl 2-{[(1-{[5-(3-chlorophenyl)-134-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)carbamoyl]amino}acetate

SMILES

CCOC(CNC(NC(Cc1ccccc1)C(Nc1nnc(-c2cccc(Cl)c2)s1)=O)=O)=O

InChI

InChI=1S/C22H22ClN5O4S/c1-2-32-18(29)13-24-21(31)25-17(11-14-7-4-3-5-8-14)19(30)26-22-28-27-20(33-22)15-9-6-10-16(23)12-15/h3-10,12,17H,2,11,13H2,1H3,(H2,24,25,31)(H,26,28,30)/t17-/m0/s1

InChI Key

FOMYXLNCNKHABW-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14242902

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

487.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.889

Distribution Coefficient, logD

3.888

Water Solubility, LogSw

-4.31

Polar Surface Area

101.611

Acid Dissociation Constant (pKa)

10.30

Base Dissociation Constant (pKb)

-1.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

V017-6506 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V017-6506 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-6506?
Check Price and Availability of V017-6506, 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 V017-6506 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-6506
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-6506
  • 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 V017-6506 available by request