AF-399/40756780
TL;DR: AF-399/40756780 (CAS 379236-30-3) is a chemical compound with molecular formula C23H21N3O4S2 and molecular weight 467.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyphenyl)-2-[5-(5-methylfuran-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide
Also Known As: AF-399/40756780, F1174-3001, N-(2-methoxyphenyl)-2-[5-(5-methylfuran-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide, 2-((3-allyl-5-(5-methylfuran-2-yl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)-N-(2-methoxyphenyl)acetamide, N-(2-methoxyphenyl)-2-{[5-(5-methylfuran-2-yl)-4-oxo-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
| Molecular Formula | C23H21N3O4S2 |
|---|---|
| Molecular Weight | 467.10 g/mol |
| LogP | 4.95182 |
| Topological Polar Surface Area | 86.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 467.09735 |
| Heavy Atoms | 32 |
| Complexity | 1353.0326 |
Chemical Identifiers
| CAS Number | 379236-30-3 |
|---|---|
| SMILES | CC1=CC=C(O1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=CC=C4OC)CC=C |
Product Overview
AF-399/40756780 (CAS 379236-30-3), with molecular formula C23H21N3O4S2 and molecular weight 467.10 g/mol. IUPAC: N-(2-methoxyphenyl)-2-[5-(5-methylfuran-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide.
Chemical Property Profile of AF-399/40756780
Property Insights of AF-399/40756780
The XLogP value of 4.95182 indicates that AF-399/40756780 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.36 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40756780. Following Lipinski's Rule of Five, AF-399/40756780 has 1 hydrogen bond donor(s) and 7 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-399/40756780?
The CAS number of AF-399/40756780 is 379236-30-3.
What is the molecular formula of AF-399/40756780?
The molecular formula of AF-399/40756780 is C23H21N3O4S2.
What is the molecular weight of AF-399/40756780?
The molecular weight of AF-399/40756780 is 467.10 g/mol.
Where can I buy AF-399/40756780?
You can request a quote for AF-399/40756780 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40756780?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40756780 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.