Crl 40053
TL;DR: Crl 40053 (CAS 59264-71-0) is a chemical compound with molecular formula C20H21Cl2N3O3S and molecular weight 453.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-[2-(2-morpholin-4-ylethylsulfinyl)benzimidazol-1-yl]methanone;hydrochloride
Also Known As: CRL 40053, 1-(p-Chlorobenzoyl)-2-(2-morpholinoethylsulfinyl)benzimidazole hydrochloride, 1-(4-Chlorobenzoyl)-2-((2-(4-morpholinyl)ethyl)sulfinyl)-1H-benzimidazole monohydrochloride, 1H-Benzimidazole, 1-(4-chlorobenzoyl)-2-((2-(4-morpholinyl)ethyl)sulfinyl)-, monohydrochloride, (4-Chlorophenyl)(2-{[2-(4-morpholinyl)ethyl]sulfinyl}-1H-benzimidazol-1-yl)methanone hydrochloride
| Molecular Formula | C20H21Cl2N3O3S |
|---|---|
| Molecular Weight | 453.07 g/mol |
| LogP | 3.2398 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.06805 |
| Heavy Atoms | 29 |
| Complexity | 1017.4883 |
Chemical Identifiers
| CAS Number | 59264-71-0 |
|---|---|
| SMILES | C1COCCN1CCS(=O)C2=NC3=CC=CC=C3N2C(=O)C4=CC=C(C=C4)Cl.Cl |
Product Overview
Crl 40053 (CAS 59264-71-0), with molecular formula C20H21Cl2N3O3S and molecular weight 453.07 g/mol. IUPAC: (4-chlorophenyl)-[2-(2-morpholin-4-ylethylsulfinyl)benzimidazol-1-yl]methanone;hydrochloride.
Chemical Property Profile of Crl 40053
Property Insights of Crl 40053
The XLogP value of 3.2398 indicates that Crl 40053 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Crl 40053. Following Lipinski's Rule of Five, Crl 40053 has 0 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 Crl 40053?
The CAS number of Crl 40053 is 59264-71-0.
What is the molecular formula of Crl 40053?
The molecular formula of Crl 40053 is C20H21Cl2N3O3S.
What is the molecular weight of Crl 40053?
The molecular weight of Crl 40053 is 453.07 g/mol.
Where can I buy Crl 40053?
You can request a quote for Crl 40053 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Crl 40053?
Yes, KEHONG BIO provides custom synthesis services for Crl 40053 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.