Y020-2698 Screening compound: 6-[(pyrimidin-2-ylsulfanyl)methyl]-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-3,4-dihydropyrimidin-4-one

Y020-2698 Screening compound: 6-[(pyrimidin-2-ylsulfanyl)methyl]-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-3,4-dihydropyrimidin-4-one
Y020-2698 Screening compound: 6-[(pyrimidin-2-ylsulfanyl)methyl]-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-2698
6-[(pyrimidin-2-ylsulfanyl)methyl]-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-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

Y020-2698

Molecular Formula

C20H19N7OS (C20 H19 N7 OS)

Compound Name

6-[(pyrimidin-2-ylsulfanyl)methyl]-2-[(4,6,8-trimethylquinazolin-2-yl)amino]-3,4-dihydropyrimidin-4-one

IUPAC name

6-[(pyrimidin-2-ylsulfanyl)methyl]-2-[(468-trimethylquinazolin-2-yl)amino]-34-dihydropyrimidin-4-one

SMILES

Cc1cc(C)c2nc(NC(N3)=NC(CSc4ncccn4)=CC3=O)nc(C)c2c1

InChI

InChI=1S/C20H19N7OS/c1-11-7-12(2)17-15(8-11)13(3)23-18(26-17)27-19-24-14(9-16(28)25-19)10-29-20-21-5-4-6-22-20/h4-9H,10H2,1-3H3,(H2,23,24,25,26,27,28)

InChI Key

WPLLKAWRMGPZNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08723577

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.406

Distribution Coefficient, logD

3.200

Water Solubility, LogSw

-3.77

Polar Surface Area

83.617

Acid Dissociation Constant (pKa)

7.62

Base Dissociation Constant (pKb)

4.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

Y020-2698 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y020-2698 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-2698?
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What is the minimum amount of Y020-2698 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-2698
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-2698
  • 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 Y020-2698 available by request