Y032-1414 Screening compound: 2,4-dichloro-N-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}benzamide

Y032-1414 Screening compound: 2,4-dichloro-N-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}benzamide
Y032-1414 Screening compound: 2,4-dichloro-N-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-1414
2,4-dichloro-N-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}benzamide

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

Y032-1414

Molecular Formula

C16H9Cl2N3O5S2 (C16 H9 Cl2 N3 O5 S2)

Compound Name

2,4-dichloro-N-{5-[(4-nitrophenyl)sulfonyl]-1,3-thiazol-2-yl}benzamide

IUPAC name

24-dichloro-N-[5-(4-nitrobenzenesulfonyl)-13-thiazol-2-yl]benzamide

SMILES

[O-][N+](c(cc1)ccc1S(c1cnc(NC(c(ccc(Cl)c2)c2Cl)=O)s1)(=O)=O)=O

InChI

InChI=1S/C16H9Cl2N3O5S2/c17-9-1-6-12(13(18)7-9)15(22)20-16-19-8-14(27-16)28(25,26)11-4-2-10(3-5-11)21(23)24/h1-8H,(H,19,20,22)

InChI Key

MBSUFFWWDPFODS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00860929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.3

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.727

Distribution Coefficient, logD

3.328

Water Solubility, LogSw

-5.19

Polar Surface Area

96.780

Acid Dissociation Constant (pKa)

6.02

Base Dissociation Constant (pKb)

-3.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y032-1414 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y032-1414 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-1414?
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What is the minimum amount of Y032-1414 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-1414
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-1414
  • 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 Y032-1414 available by request