D458-1237 Screening compound: N-(2-chlorophenyl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]acetamide

D458-1237 Screening compound: N-(2-chlorophenyl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]acetamide
D458-1237 Screening compound: N-(2-chlorophenyl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D458-1237
N-(2-chlorophenyl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]acetamide

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

D458-1237

Molecular Formula

C18H19ClN4OS (C18 H19 ClN4 OS)

Compound Name

N-(2-chlorophenyl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]acetamide

IUPAC name

N-(2-chlorophenyl)-2-[1-(45-dimethyl-13-thiazol-2-yl)-35-dimethyl-1H-pyrazol-4-yl]acetamide

SMILES

Cc1c(CC(Nc(cccc2)c2Cl)=O)c(C)nn1-c1nc(C)c(C)s1

InChI

InChI=1S/C18H19ClN4OS/c1-10-13(4)25-18(20-10)23-12(3)14(11(2)22-23)9-17(24)21-16-8-6-5-7-15(16)19/h5-8H,9H2,1-4H3,(H,21,24)

InChI Key

WQCQZDRDACKEBP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27588057

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.465

Distribution Coefficient, logD

3.184

Water Solubility, LogSw

-3.63

Polar Surface Area

47.234

Acid Dissociation Constant (pKa)

10.19

Base Dissociation Constant (pKb)

7.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

D458-1237 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D458-1237 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D458-1237?
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What is the minimum amount of D458-1237 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D458-1237
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D458-1237
  • 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 D458-1237 available by request