P621-0272 Screening compound: 2-[(4-cyclohexylpiperazino)carbonyl]-2,4-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

P621-0272 Screening compound: 2-[(4-cyclohexylpiperazino)carbonyl]-2,4-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
P621-0272 Screening compound: 2-[(4-cyclohexylpiperazino)carbonyl]-2,4-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P621-0272
2-[(4-cyclohexylpiperazino)carbonyl]-2,4-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

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

P621-0272

Molecular Formula

C20H28N4O3 (C20 H28 N4 O3)

Compound Name

2-[(4-cyclohexylpiperazino)carbonyl]-2,4-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

IUPAC name

2-(4-cyclohexylpiperazine-1-carbonyl)-24-dimethyl-2H3H4H-pyrido[32-b][14]oxazin-3-one

SMILES

CC1(C(N(CC2)CCN2C2CCCCC2)=O)Oc2cccnc2N(C)C1=O

InChI

InChI=1S/C20H28N4O3/c1-20(18(25)22(2)17-16(27-20)9-6-10-21-17)19(26)24-13-11-23(12-14-24)15-7-4-3-5-8-15/h6,9-10,15H,3-5,7-8,11-14H2,1-2H3/t20-/m1/s1

InChI Key

AGYMTSAAOTWNLQ-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD27607062

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.006

Distribution Coefficient, logD

1.549

Water Solubility, LogSw

-2.10

Polar Surface Area

52.431

Acid Dissociation Constant (pKa)

28.29

Base Dissociation Constant (pKb)

7.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

65.00

P621-0272 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Ligand-Gated Ion Channels Library (3887 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Eye
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
  • Others
Mechanism of action:
  • Receptor's ligands
  • Epigenetic
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P621-0272 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P621-0272?
Check Price and Availability of P621-0272, 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 P621-0272 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P621-0272
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P621-0272
  • 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 P621-0272 available by request