L958-0981 Screening compound: N-benzyl-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-methylacetamide

L958-0981 Screening compound: N-benzyl-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-methylacetamide
L958-0981 Screening compound: N-benzyl-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L958-0981
N-benzyl-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-methylacetamide

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

L958-0981

Molecular Formula

C23H20ClN3OS (C23 H20 ClN3 OS)

Compound Name

N-benzyl-2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-methylacetamide

IUPAC name

N-benzyl-2-{2-[4-(4-chlorophenyl)-13-thiazol-2-yl]-1H-pyrrol-1-yl}-N-methylacetamide

SMILES

CN(Cc1ccccc1)C(Cn1c(-c2nc(-c(cc3)ccc3Cl)cs2)ccc1)=O

InChI

InChI=1S/C23H20ClN3OS/c1-26(14-17-6-3-2-4-7-17)22(28)15-27-13-5-8-21(27)23-25-20(16-29-23)18-9-11-19(24)12-10-18/h2-13,16H,14-15H2,1H3

InChI Key

CBHJPZQGPVNWEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27490038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.95

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.174

Distribution Coefficient, logD

6.174

Water Solubility, LogSw

-6.22

Polar Surface Area

27.185

Acid Dissociation Constant (pKa)

22.52

Base Dissociation Constant (pKb)

0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

L958-0981 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L958-0981 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L958-0981?
Check Price and Availability of L958-0981, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L958-0981 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L958-0981
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L958-0981
  • 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 L958-0981 available by request