AN-465/41165899
TL;DR: AN-465/41165899 (CAS 665013-15-0) is a chemical compound with molecular formula C21H23N3O2S2 and molecular weight 413.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide
Also Known As: AN-465/41165899, N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide, N-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)carbamothioyl)-3-isobutoxybenzamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-N'-(3-isobutoxybenzoyl)thiourea
| Molecular Formula | C21H23N3O2S2 |
|---|---|
| Molecular Weight | 413.12 g/mol |
| LogP | 4.66018 |
| Topological Polar Surface Area | 74.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.12317 |
| Heavy Atoms | 28 |
| Complexity | 928.2173 |
Chemical Identifiers
| CAS Number | 665013-15-0 |
|---|---|
| SMILES | CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C3=C(S2)CCCC3)C#N |
Product Overview
AN-465/41165899 (CAS 665013-15-0), with molecular formula C21H23N3O2S2 and molecular weight 413.12 g/mol. IUPAC: N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-(2-methylpropoxy)benzamide.
Chemical Property Profile of AN-465/41165899
Property Insights of AN-465/41165899
The XLogP value of 4.66018 indicates that AN-465/41165899 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.15 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/41165899. Following Lipinski's Rule of Five, AN-465/41165899 has 2 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 AN-465/41165899?
The CAS number of AN-465/41165899 is 665013-15-0.
What is the molecular formula of AN-465/41165899?
The molecular formula of AN-465/41165899 is C21H23N3O2S2.
What is the molecular weight of AN-465/41165899?
The molecular weight of AN-465/41165899 is 413.12 g/mol.
Where can I buy AN-465/41165899?
You can request a quote for AN-465/41165899 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41165899?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41165899 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.