G629-0137 Screening compound: 4-{[2-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]methyl}-N-cyclopropylbenzamide

G629-0137 Screening compound: 4-{[2-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]methyl}-N-cyclopropylbenzamide
G629-0137 Screening compound: 4-{[2-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]methyl}-N-cyclopropylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G629-0137
4-{[2-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]methyl}-N-cyclopropylbenzamide

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

G629-0137

Molecular Formula

C28H25ClN4O3S (C28 H25 ClN4 O3 S)

Compound Name

4-{[2-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]methyl}-N-cyclopropylbenzamide

IUPAC name

4-{[2-({[(5-chloro-2-methylphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-34-dihydroquinazolin-3-yl]methyl}-N-cyclopropylbenzamide

SMILES

Cc(ccc(Cl)c1)c1NC(CSC(N1Cc(cc2)ccc2C(NC2CC2)=O)=Nc(cccc2)c2C1=O)=O

InChI

InChI=1S/C28H25ClN4O3S/c1-17-6-11-20(29)14-24(17)31-25(34)16-37-28-32-23-5-3-2-4-22(23)27(36)33(28)15-18-7-9-19(10-8-18)26(35)30-21-12-13-21/h2-11,14,21H,12-13,15-16H2,1H3,(H,30,35)(H,31,34)

InChI Key

SDBIEHNQKNMCFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15023647

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.05

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.065

Distribution Coefficient, logD

4.065

Water Solubility, LogSw

-4.41

Polar Surface Area

72.692

Acid Dissociation Constant (pKa)

10.90

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with G629-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G629-0137?
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What is the minimum amount of G629-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G629-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G629-0137
  • 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 G629-0137 available by request