L958-1214 Screening compound: 2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-[(furan-2-yl)methyl]-N-methylacetamide

L958-1214 Screening compound: 2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-[(furan-2-yl)methyl]-N-methylacetamide
L958-1214 Screening compound: 2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-[(furan-2-yl)methyl]-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L958-1214
2-{2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}-N-[(furan-2-yl)methyl]-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

L958-1214

Molecular Formula

C21H18ClN3O2S (C21 H18 ClN3 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CN(Cc1ccco1)C(Cn1c(-c2nc(-c(cc3)ccc3Cl)cs2)ccc1)=O

InChI

InChI=1S/C21H18ClN3O2S/c1-24(12-17-4-3-11-27-17)20(26)13-25-10-2-5-19(25)21-23-18(14-28-21)15-6-8-16(22)9-7-15/h2-11,14H,12-13H2,1H3

InChI Key

CJMCDCGCZXVLBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27490095

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.381

Distribution Coefficient, logD

5.381

Water Solubility, LogSw

-6.03

Polar Surface Area

34.934

Acid Dissociation Constant (pKa)

22.52

Base Dissociation Constant (pKb)

0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

L958-1214 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L958-1214 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L958-1214?
Check Price and Availability of L958-1214, 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 L958-1214 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L958-1214
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L958-1214
  • 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 L958-1214 available by request