C202-1646 Screening compound: 2-{2-[5-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-phenylacetamide

C202-1646 Screening compound: 2-{2-[5-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-phenylacetamide
C202-1646 Screening compound: 2-{2-[5-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-1646
2-{2-[5-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-phenylacetamide

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

C202-1646

Molecular Formula

C29H28N4O4S (C29 H28 N4 O4 S)

Compound Name

2-{2-[5-(3,4-dimethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}-N-phenylacetamide

IUPAC name

2-{2-[5-(34-dimethoxyphenyl)-3-(4-methylphenyl)-45-dihydro-1H-pyrazol-1-yl]-4-oxo-45-dihydro-13-thiazol-5-yl}-N-phenylacetamide

SMILES

Cc(cc1)ccc1C(CC1c(cc2)cc(OC)c2OC)=NN1C(SC1CC(Nc2ccccc2)=O)=NC1=O

InChI

InChI=1S/C29H28N4O4S/c1-18-9-11-19(12-10-18)22-16-23(20-13-14-24(36-2)25(15-20)37-3)33(32-22)29-31-28(35)26(38-29)17-27(34)30-21-7-5-4-6-8-21/h4-15,23,26H,16-17H2,1-3H3,(H,30,34)

InChI Key

FIQXLMRBKZELMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14730528

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

528.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.905

Distribution Coefficient, logD

4.905

Water Solubility, LogSw

-4.70

Polar Surface Area

74.233

Acid Dissociation Constant (pKa)

12.03

Base Dissociation Constant (pKb)

1.70

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

24.10

References: we are preparing a list of scientific research reports with C202-1646 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-1646?
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What is the minimum amount of C202-1646 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-1646
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-1646
  • 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 C202-1646 available by request