AF-399/15128344
TL;DR: AF-399/15128344 (CAS 315678-67-2) is a chemical compound with molecular formula C21H20FN3O2S2 and molecular weight 429.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-3-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]propanamide
Also Known As: AF-399/15128344, 3-((3-allyl-4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-(4-fluorophenyl)propanamide, F0863-0119, N-(4-fluorophenyl)-3-{[12-oxo-11-(prop-2-en-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl}propanamide, N-(4-Fluorophenyl)-3-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]propanamide
| Molecular Formula | C21H20FN3O2S2 |
|---|---|
| Molecular Weight | 429.10 g/mol |
| LogP | 4.3927 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 429.09808 |
| Heavy Atoms | 29 |
| Complexity | 1135.519 |
Chemical Identifiers
| CAS Number | 315678-67-2 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCCC(=O)NC3=CC=C(C=C3)F)SC4=C2CCC4 |
Product Overview
AF-399/15128344 (CAS 315678-67-2), with molecular formula C21H20FN3O2S2 and molecular weight 429.10 g/mol. IUPAC: N-(4-fluorophenyl)-3-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]propanamide.
Chemical Property Profile of AF-399/15128344
Property Insights of AF-399/15128344
The XLogP value of 4.3927 indicates that AF-399/15128344 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15128344. Following Lipinski's Rule of Five, AF-399/15128344 has 1 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 AF-399/15128344?
The CAS number of AF-399/15128344 is 315678-67-2.
What is the molecular formula of AF-399/15128344?
The molecular formula of AF-399/15128344 is C21H20FN3O2S2.
What is the molecular weight of AF-399/15128344?
The molecular weight of AF-399/15128344 is 429.10 g/mol.
Where can I buy AF-399/15128344?
You can request a quote for AF-399/15128344 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15128344?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15128344 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.