D082-0274 Screening compound: N3-(5-chloro-2-methoxyphenyl)-N2-(2,3-dimethylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide

D082-0274 Screening compound: N3-(5-chloro-2-methoxyphenyl)-N2-(2,3-dimethylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide
D082-0274 Screening compound: N3-(5-chloro-2-methoxyphenyl)-N2-(2,3-dimethylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D082-0274
N3-(5-chloro-2-methoxyphenyl)-N2-(2,3-dimethylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide

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

D082-0274

Molecular Formula

C24H21ClN4O4S (C24 H21 ClN4 O4 S)

Compound Name

N3-(5-chloro-2-methoxyphenyl)-N2-(2,3-dimethylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-2,3-dicarboxamide

IUPAC name

N3-(5-chloro-2-methoxyphenyl)-N2-(23-dimethylphenyl)-7-methyl-5-oxo-5H-[13]thiazolo[32-a]pyrimidine-23-dicarboxamide

SMILES

Cc1cccc(NC(C(SC2=NC(C)=C3)=C(C(Nc(cc(cc4)Cl)c4OC)=O)N2C3=O)=O)c1C

InChI

InChI=1S/C24H21ClN4O4S/c1-12-6-5-7-16(14(12)3)27-23(32)21-20(29-19(30)10-13(2)26-24(29)34-21)22(31)28-17-11-15(25)8-9-18(17)33-4/h5-11H,1-4H3,(H,27,32)(H,28,31)

InChI Key

MRJPKBSOIJFBHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06639604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.286

Distribution Coefficient, logD

1.155

Water Solubility, LogSw

-4.63

Polar Surface Area

78.493

Acid Dissociation Constant (pKa)

4.27

Base Dissociation Constant (pKb)

-1.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

D082-0274 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with D082-0274 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D082-0274?
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What is the minimum amount of D082-0274 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D082-0274
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D082-0274
  • 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 D082-0274 available by request