AN-465/41168105
TL;DR: AN-465/41168105 (CAS 445419-90-9) is a chemical compound with molecular formula C24H16ClN3O3S and molecular weight 461.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: AN-465/41168105, N-[[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide, N-{[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide, N-((2-(2-chloro-4-methylphenyl)benzo[d]oxazol-5-yl)carbamothioyl)benzofuran-2-carboxamide, N-(1-benzofuran-2-ylcarbonyl)-N'-[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]thiourea
| Molecular Formula | C24H16ClN3O3S |
|---|---|
| Molecular Weight | 461.06 g/mol |
| LogP | 6.32962 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 461.0601 |
| Heavy Atoms | 32 |
| Complexity | 1472.2457 |
Chemical Identifiers
| CAS Number | 445419-90-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4)Cl |
Product Overview
AN-465/41168105 (CAS 445419-90-9), with molecular formula C24H16ClN3O3S and molecular weight 461.06 g/mol. IUPAC: N-[[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of AN-465/41168105
Property Insights of AN-465/41168105
The XLogP value of 6.32962 indicates that AN-465/41168105 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/41168105. Following Lipinski's Rule of Five, AN-465/41168105 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/41168105?
The CAS number of AN-465/41168105 is 445419-90-9.
What is the molecular formula of AN-465/41168105?
The molecular formula of AN-465/41168105 is C24H16ClN3O3S.
What is the molecular weight of AN-465/41168105?
The molecular weight of AN-465/41168105 is 461.06 g/mol.
Where can I buy AN-465/41168105?
You can request a quote for AN-465/41168105 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41168105?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41168105 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.