AN-465/41162140
TL;DR: AN-465/41162140 (CAS 665013-13-8) is a chemical compound with molecular formula C22H15Cl2N3O3S and molecular weight 471.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichloro-N-[[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide
Also Known As: AN-465/41162140, N-(3,4-dichlorobenzoyl)-N'-[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]thiourea, 3,4-dichloro-N-{[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide, 3,4-dichloro-N-[[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide, 3,4-dichloro-N-[[(3E)-3-(5-methyl-3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]benzamide
| Molecular Formula | C22H15Cl2N3O3S |
|---|---|
| Molecular Weight | 471.02 g/mol |
| LogP | 5.94242 |
| Topological Polar Surface Area | 87.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.02112 |
| Heavy Atoms | 31 |
| Complexity | 1337.0829 |
Chemical Identifiers
| CAS Number | 665013-13-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC(=N2)C3=C(C=CC(=C3)NC(=S)NC(=O)C4=CC(=C(C=C4)Cl)Cl)O |
Product Overview
AN-465/41162140 (CAS 665013-13-8), with molecular formula C22H15Cl2N3O3S and molecular weight 471.02 g/mol. IUPAC: 3,4-dichloro-N-[[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of AN-465/41162140
Property Insights of AN-465/41162140
The XLogP value of 5.94242 indicates that AN-465/41162140 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.39 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/41162140. Following Lipinski's Rule of Five, AN-465/41162140 has 3 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-465/41162140?
The CAS number of AN-465/41162140 is 665013-13-8.
What is the molecular formula of AN-465/41162140?
The molecular formula of AN-465/41162140 is C22H15Cl2N3O3S.
What is the molecular weight of AN-465/41162140?
The molecular weight of AN-465/41162140 is 471.02 g/mol.
Where can I buy AN-465/41162140?
You can request a quote for AN-465/41162140 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41162140?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41162140 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.