ASN 06580311
TL;DR: ASN 06580311 (CAS 605629-17-2) is a chemical compound with molecular formula C21H23ClN4S and molecular weight 398.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-chloro-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide
Also Known As: ASN 06580311, 4-(6-chloro-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide, 1-PIPERIDINECARBOTHIOAMIDE, 4-(5-CHLORO-1H-BENZIMIDAZOL-2-YL)-N-(3,5-DIMETHYLPHENYL)-, 1-Piperidinecarbothioamide, 4-(5-chloro-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)- (9CI)
| Molecular Formula | C21H23ClN4S |
|---|---|
| Molecular Weight | 398.13 g/mol |
| LogP | 5.40954 |
| Topological Polar Surface Area | 43.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 398.1332 |
| Heavy Atoms | 27 |
| Complexity | 968.7603 |
Chemical Identifiers
| CAS Number | 605629-17-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)C3=NC4=C(N3)C=C(C=C4)Cl)C |
Product Overview
ASN 06580311 (CAS 605629-17-2), with molecular formula C21H23ClN4S and molecular weight 398.13 g/mol. IUPAC: 4-(6-chloro-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide.
Chemical Property Profile of ASN 06580311
Property Insights of ASN 06580311
The XLogP value of 5.40954 indicates that ASN 06580311 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.95 Ų, ASN 06580311 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ASN 06580311 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ASN 06580311?
The CAS number of ASN 06580311 is 605629-17-2.
What is the molecular formula of ASN 06580311?
The molecular formula of ASN 06580311 is C21H23ClN4S.
What is the molecular weight of ASN 06580311?
The molecular weight of ASN 06580311 is 398.13 g/mol.
Where can I buy ASN 06580311?
You can request a quote for ASN 06580311 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 06580311?
Yes, KEHONG BIO provides custom synthesis services for ASN 06580311 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.