AN-465/41161806
TL;DR: AN-465/41161806 (CAS 445416-93-3) is a chemical compound with molecular formula C27H20ClN3O2S and molecular weight 485.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide
Also Known As: AN-465/41161806, N-[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-N'-(2-naphthoyl)thiourea, N-{[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}naphthalene-2-carboxamide, N-[[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide, N-((4-chloro-3-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-2-naphthamide
| Molecular Formula | C27H20ClN3O2S |
|---|---|
| Molecular Weight | 485.10 g/mol |
| LogP | 7.04504 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 485.09647 |
| Heavy Atoms | 34 |
| Complexity | 1592.2345 |
Chemical Identifiers
| CAS Number | 445416-93-3 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5C=C4)Cl)C |
Product Overview
AN-465/41161806 (CAS 445416-93-3), with molecular formula C27H20ClN3O2S and molecular weight 485.10 g/mol. IUPAC: N-[[4-chloro-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]naphthalene-2-carboxamide.
Chemical Property Profile of AN-465/41161806
Property Insights of AN-465/41161806
The XLogP value of 7.04504 indicates that AN-465/41161806 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/41161806. Following Lipinski's Rule of Five, AN-465/41161806 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/41161806?
The CAS number of AN-465/41161806 is 445416-93-3.
What is the molecular formula of AN-465/41161806?
The molecular formula of AN-465/41161806 is C27H20ClN3O2S.
What is the molecular weight of AN-465/41161806?
The molecular weight of AN-465/41161806 is 485.10 g/mol.
Where can I buy AN-465/41161806?
You can request a quote for AN-465/41161806 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41161806?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41161806 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.