C301-9644 Screening compound: 4-ETHYL-N-[5-METHYL-1-PROPYL-3-(4H-1,2,4-TRIAZOL-4-YL)-1H-PYRAZOL-4-YL]BENZENE-1-SULFONAMIDE

C301-9644 Screening compound: 4-ETHYL-N-[5-METHYL-1-PROPYL-3-(4H-1,2,4-TRIAZOL-4-YL)-1H-PYRAZOL-4-YL]BENZENE-1-SULFONAMIDE
C301-9644 Screening compound: 4-ETHYL-N-[5-METHYL-1-PROPYL-3-(4H-1,2,4-TRIAZOL-4-YL)-1H-PYRAZOL-4-YL]BENZENE-1-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-9644
4-ETHYL-N-[5-METHYL-1-PROPYL-3-(4H-1,2,4-TRIAZOL-4-YL)-1H-PYRAZOL-4-YL]BENZENE-1-SULFONAMIDE

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

C301-9644

Molecular Formula

C17H22N6O2S (C17 H22 N6 O2 S)

Compound Name

4-ETHYL-N-[5-METHYL-1-PROPYL-3-(4H-1,2,4-TRIAZOL-4-YL)-1H-PYRAZOL-4-YL]BENZENE-1-SULFONAMIDE

IUPAC name

n/a

SMILES

CCCn(c(C)c1NS(c2ccc(CC)cc2)(=O)=O)nc1-n1cnnc1

InChI

InChI=1S/C17H22N6O2S/c1-4-10-23-13(3)16(17(20-23)22-11-18-19-12-22)21-26(24,25)15-8-6-14(5-2)7-9-15/h6-9,11-12,21H,4-5,10H2,1-3H3

InChI Key

JCJLWBCKCUDYSE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14746045

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.137

Distribution Coefficient, logD

-1.762

Water Solubility, LogSw

-2.80

Polar Surface Area

79.412

Acid Dissociation Constant (pKa)

4.20

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.00

C301-9644 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C301-9644 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-9644?
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What is the minimum amount of C301-9644 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-9644
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-9644
  • 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 C301-9644 available by request