8010-5535 Screening compound: 4-{[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino}benzene-1-sulfonamide

8010-5535 Screening compound: 4-{[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino}benzene-1-sulfonamide
8010-5535 Screening compound: 4-{[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-5535
4-{[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino}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

8010-5535

Molecular Formula

C17H17N3O2S2 (C17 H17 N3 O2 S2)

Compound Name

4-{[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino}benzene-1-sulfonamide

IUPAC name

4-{[4-(34-dimethylphenyl)-13-thiazol-2-yl]amino}benzene-1-sulfonamide

SMILES

Cc(cc1)c(C)cc1-c1csc(Nc(cc2)ccc2S(N)(=O)=O)n1

InChI

InChI=1S/C17H17N3O2S2/c1-11-3-4-13(9-12(11)2)16-10-23-17(20-16)19-14-5-7-15(8-6-14)24(18,21)22/h3-10H,1-2H3,(H,19,20)(H2,18,21,22)

InChI Key

IAOGHVOPGSQHII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02109658

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

359.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.509

Distribution Coefficient, logD

4.508

Water Solubility, LogSw

-4.37

Polar Surface Area

69.529

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

3.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

8010-5535 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 8010-5535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-5535?
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What is the minimum amount of 8010-5535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-5535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-5535
  • 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 8010-5535 available by request