Y030-5985 Screening compound: 2,6-dichloro-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide

Y030-5985 Screening compound: 2,6-dichloro-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide
Y030-5985 Screening compound: 2,6-dichloro-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-5985
2,6-dichloro-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}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

Y030-5985

Molecular Formula

C16H11Cl2N3O3S2 (C16 H11 Cl2 N3 O3 S2)

Compound Name

2,6-dichloro-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide

IUPAC name

26-dichloro-N-{4-[(13-thiazol-2-yl)sulfamoyl]phenyl}benzamide

SMILES

O=C(c(c(Cl)ccc1)c1Cl)Nc(cc1)ccc1S(Nc1nccs1)(=O)=O

InChI

InChI=1S/C16H11Cl2N3O3S2/c17-12-2-1-3-13(18)14(12)15(22)20-10-4-6-11(7-5-10)26(23,24)21-16-19-8-9-25-16/h1-9H,(H,19,21)(H,20,22)

InChI Key

BCASNONCGDGDII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01353110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.669

Distribution Coefficient, logD

3.259

Water Solubility, LogSw

-4.57

Polar Surface Area

74.458

Acid Dissociation Constant (pKa)

7.20

Base Dissociation Constant (pKb)

0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y030-5985 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y030-5985 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-5985?
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What is the minimum amount of Y030-5985 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-5985
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-5985
  • 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 Y030-5985 available by request