AN-465/41674142
TL;DR: AN-465/41674142 (CAS 531538-48-4) is a chemical compound with molecular formula C22H23N3O3S2 and molecular weight 441.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetylphenyl)-2-[[6-(propanoylamino)-1,3-benzothiazol-2-yl]sulfanyl]butanamide
Also Known As: AN-465/41674142, N-(4-acetylphenyl)-2-[[6-(propanoylamino)-1,3-benzothiazol-2-yl]sulfanyl]butanamide, N-(4-acetylphenyl)-2-{[6-(propionylamino)-1,3-benzothiazol-2-yl]sulfanyl}butanamide
| Molecular Formula | C22H23N3O3S2 |
|---|---|
| Molecular Weight | 441.12 g/mol |
| LogP | 5.3568 |
| Topological Polar Surface Area | 88.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 441.11807 |
| Heavy Atoms | 30 |
| Complexity | 1076.9263 |
Chemical Identifiers
| CAS Number | 531538-48-4 |
|---|---|
| SMILES | CCC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC3=C(S2)C=C(C=C3)NC(=O)CC |
Product Overview
AN-465/41674142 (CAS 531538-48-4), with molecular formula C22H23N3O3S2 and molecular weight 441.12 g/mol. IUPAC: N-(4-acetylphenyl)-2-[[6-(propanoylamino)-1,3-benzothiazol-2-yl]sulfanyl]butanamide.
Chemical Property Profile of AN-465/41674142
Property Insights of AN-465/41674142
The XLogP value of 5.3568 indicates that AN-465/41674142 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/41674142. Following Lipinski's Rule of Five, AN-465/41674142 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/41674142?
The CAS number of AN-465/41674142 is 531538-48-4.
What is the molecular formula of AN-465/41674142?
The molecular formula of AN-465/41674142 is C22H23N3O3S2.
What is the molecular weight of AN-465/41674142?
The molecular weight of AN-465/41674142 is 441.12 g/mol.
Where can I buy AN-465/41674142?
You can request a quote for AN-465/41674142 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41674142?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41674142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.