Y020-2696 Screening compound: 2-[(4,6-dimethylquinazolin-2-yl)amino]-6-[(pyridin-2-ylsulfanyl)methyl]-3,4-dihydropyrimidin-4-one

Y020-2696 Screening compound: 2-[(4,6-dimethylquinazolin-2-yl)amino]-6-[(pyridin-2-ylsulfanyl)methyl]-3,4-dihydropyrimidin-4-one
Y020-2696 Screening compound: 2-[(4,6-dimethylquinazolin-2-yl)amino]-6-[(pyridin-2-ylsulfanyl)methyl]-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-2696
2-[(4,6-dimethylquinazolin-2-yl)amino]-6-[(pyridin-2-ylsulfanyl)methyl]-3,4-dihydropyrimidin-4-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

Y020-2696

Molecular Formula

C20H18N6OS (C20 H18 N6 OS)

Compound Name

2-[(4,6-dimethylquinazolin-2-yl)amino]-6-[(pyridin-2-ylsulfanyl)methyl]-3,4-dihydropyrimidin-4-one

IUPAC name

2-[(46-dimethylquinazolin-2-yl)amino]-6-[(pyridin-2-ylsulfanyl)methyl]-34-dihydropyrimidin-4-one

SMILES

Cc1ccc2nc(NC(N3)=NC(CSc4ncccc4)=CC3=O)nc(C)c2c1

InChI

InChI=1S/C20H18N6OS/c1-12-6-7-16-15(9-12)13(2)22-19(24-16)26-20-23-14(10-17(27)25-20)11-28-18-5-3-4-8-21-18/h3-10H,11H2,1-2H3,(H2,22,23,24,25,26,27)

InChI Key

PQIVSWRZRWWTKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08723564

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.466

Distribution Coefficient, logD

3.396

Water Solubility, LogSw

-3.85

Polar Surface Area

73.098

Acid Dissociation Constant (pKa)

8.16

Base Dissociation Constant (pKb)

3.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

Y020-2696 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y020-2696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-2696?
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What is the minimum amount of Y020-2696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-2696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-2696
  • 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 Y020-2696 available by request