C202-0975 Screening compound: N-(2,4-dimethylphenyl)-5-methyl-7-(4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

C202-0975 Screening compound: N-(2,4-dimethylphenyl)-5-methyl-7-(4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
C202-0975 Screening compound: N-(2,4-dimethylphenyl)-5-methyl-7-(4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-0975
N-(2,4-dimethylphenyl)-5-methyl-7-(4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

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

C202-0975

Molecular Formula

C30H31N5OS (C30 H31 N5 OS)

Compound Name

N-(2,4-dimethylphenyl)-5-methyl-7-(4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

IUPAC name

N-(24-dimethylphenyl)-5-methyl-7-(4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4H7H-[124]triazolo[15-a]pyrimidine-6-carboxamide

SMILES

Cc1ccc(C(C(C(Nc2c(C)cc(C)cc2)=O)=C(C)Nc2n3)n2nc3SCc2cc(C)ccc2)cc1

InChI

InChI=1S/C30H31N5OS/c1-18-9-12-24(13-10-18)27-26(28(36)32-25-14-11-20(3)15-21(25)4)22(5)31-29-33-30(34-35(27)29)37-17-23-8-6-7-19(2)16-23/h6-16,27H,17H2,1-5H3,(H,32,36)(H,31,33,34)/t27-/m0/s1

InChI Key

WVIUFZDHWIMFNK-MHZLTWQESA-N

MDL Number (MFCD)

MFCD14730247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509.68

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.315

Distribution Coefficient, logD

7.315

Water Solubility, LogSw

-5.50

Polar Surface Area

57.893

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

3.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with C202-0975 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-0975?
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What is the minimum amount of C202-0975 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-0975
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-0975
  • 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 C202-0975 available by request