8008-3169 Screening compound: 2-chloro-N-(3-hydroxyphenyl)-5-(pyrrolidine-1-sulfonyl)benzamide

8008-3169 Screening compound: 2-chloro-N-(3-hydroxyphenyl)-5-(pyrrolidine-1-sulfonyl)benzamide
8008-3169 Screening compound: 2-chloro-N-(3-hydroxyphenyl)-5-(pyrrolidine-1-sulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-3169
2-chloro-N-(3-hydroxyphenyl)-5-(pyrrolidine-1-sulfonyl)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

8008-3169

Molecular Formula

C17H17ClN2O4S (C17 H17 ClN2 O4 S)

Compound Name

2-chloro-N-(3-hydroxyphenyl)-5-(pyrrolidine-1-sulfonyl)benzamide

IUPAC name

2-chloro-N-(3-hydroxyphenyl)-5-(pyrrolidine-1-sulfonyl)benzamide

SMILES

Oc1cccc(NC(c(cc(cc2)S(N3CCCC3)(=O)=O)c2Cl)=O)c1

InChI

InChI=1S/C17H17ClN2O4S/c18-16-7-6-14(25(23,24)20-8-1-2-9-20)11-15(16)17(22)19-12-4-3-5-13(21)10-12/h3-7,10-11,21H,1-2,8-9H2,(H,19,22)

InChI Key

YAFQMPJWKLIAPQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01122484

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.85

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.948

Distribution Coefficient, logD

2.930

Water Solubility, LogSw

-3.50

Polar Surface Area

73.024

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

-3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

8008-3169 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

Lipid Metabolism Library (9174 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 8008-3169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-3169?
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What is the minimum amount of 8008-3169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-3169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-3169
  • 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 8008-3169 available by request