N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide
TL;DR: N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide (CAS 853713-84-5) is a chemical compound with molecular formula C21H24ClN5O3S and molecular weight 461.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide
Also Known As: N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide, N-(1H-benzoimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonyl-benzamide, N-[(1H-Benzimidazol-2-yl)methyl]-2-chloro-5-(4-ethylpiperazine-1-sulfonyl)benzamide
| Molecular Formula | C21H24ClN5O3S |
|---|---|
| Molecular Weight | 461.13 g/mol |
| LogP | 2.4725 |
| Topological Polar Surface Area | 98.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 461.12885 |
| Heavy Atoms | 31 |
| Complexity | 1169.7006 |
Chemical Identifiers
| CAS Number | 853713-84-5 |
|---|---|
| SMILES | CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3=NC4=CC=CC=C4N3 |
Product Overview
N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide (CAS 853713-84-5), with molecular formula C21H24ClN5O3S and molecular weight 461.13 g/mol. IUPAC: N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide.
Chemical Property Profile of N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide
Property Insights of N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide
The XLogP value of 2.4725 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide. The TPSA of 98.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide. Following Lipinski's Rule of Five, N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide has 2 hydrogen bond donor(s) and 5 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 N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide?
The CAS number of N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide is 853713-84-5.
What is the molecular formula of N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide?
The molecular formula of N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide is C21H24ClN5O3S.
What is the molecular weight of N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide?
The molecular weight of N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide is 461.13 g/mol.
Where can I buy N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide?
You can request a quote for N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-benzimidazol-2-ylmethyl)-2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.