AF-399/15599197
TL;DR: AF-399/15599197 (CAS 379250-47-2) is a chemical compound with molecular formula C23H25N3O3S2 and molecular weight 455.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethoxyphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: AF-399/15599197, N-(2-ethoxyphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide, 2-[(3-allyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide, 2-((3-allyl-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-(2-ethoxyphenyl)acetamide, N-(2-ethoxyphenyl)-2-(4-oxo-3-prop-2-enyl(3,5,6,7,8-pentahydrobenzo[b]thiophen o[2,3-d]pyrimidin-2-ylthio))acetamide
| Molecular Formula | C23H25N3O3S2 |
|---|---|
| Molecular Weight | 455.13 g/mol |
| LogP | 4.6523 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 455.13373 |
| Heavy Atoms | 31 |
| Complexity | 1182.7588 |
Chemical Identifiers
| CAS Number | 379250-47-2 |
|---|---|
| SMILES | CCOC1=CC=CC=C1NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C |
Product Overview
AF-399/15599197 (CAS 379250-47-2), with molecular formula C23H25N3O3S2 and molecular weight 455.13 g/mol. IUPAC: N-(2-ethoxyphenyl)-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of AF-399/15599197
Property Insights of AF-399/15599197
The XLogP value of 4.6523 indicates that AF-399/15599197 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15599197. Following Lipinski's Rule of Five, AF-399/15599197 has 1 hydrogen bond donor(s) and 6 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 AF-399/15599197?
The CAS number of AF-399/15599197 is 379250-47-2.
What is the molecular formula of AF-399/15599197?
The molecular formula of AF-399/15599197 is C23H25N3O3S2.
What is the molecular weight of AF-399/15599197?
The molecular weight of AF-399/15599197 is 455.13 g/mol.
Where can I buy AF-399/15599197?
You can request a quote for AF-399/15599197 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15599197?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15599197 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.