1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide
TL;DR: 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide (CAS 640713-00-4) is a chemical compound with molecular formula C18H14ClN3O2S and molecular weight 371.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)-5-oxopyrrolidine-3-carboxamide
Also Known As: BAS 07124102, N-(benzo[d]thiazol-2-yl)-1-(4-chlorophenyl)-5-oxopyrrolidine-3-carboxamide, 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide, N-benzothiazol-2-yl[1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]carboxamide, N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)-5-oxopyrrolidine-3-carboxamide
| Molecular Formula | C18H14ClN3O2S |
|---|---|
| Molecular Weight | 371.05 g/mol |
| LogP | 3.9413 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.04953 |
| Heavy Atoms | 25 |
| Complexity | 921.3694 |
Chemical Identifiers
| CAS Number | 640713-00-4 |
|---|---|
| SMILES | C1C(CN(C1=O)C2=CC=C(C=C2)Cl)C(=O)NC3=NC4=CC=CC=C4S3 |
Product Overview
1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide (CAS 640713-00-4), with molecular formula C18H14ClN3O2S and molecular weight 371.05 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)-5-oxopyrrolidine-3-carboxamide.
Chemical Property Profile of 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide
Property Insights of 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide
The XLogP value of 3.9413 indicates that 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide. Following Lipinski's Rule of Five, 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide?
The CAS number of 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide is 640713-00-4.
What is the molecular formula of 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide?
The molecular formula of 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide is C18H14ClN3O2S.
What is the molecular weight of 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide?
The molecular weight of 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide is 371.05 g/mol.
Where can I buy 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide?
You can request a quote for 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chloro-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid benzothiazol-2-ylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.