AF-399/15539089
TL;DR: AF-399/15539089 (CAS 379247-90-2) is a chemical compound with molecular formula C21H19N3O2S2 and molecular weight 409.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-6-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one
Also Known As: AF-399/15539089, 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-6-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one, 3-allyl-2-{[(3,5-dimethyl-4-isoxazolyl)methyl]sulfanyl}-6-phenylthieno[2,3-d]pyrimidin-4(3H)-one, 2-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-6-phenyl-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C21H19N3O2S2 |
|---|---|
| Molecular Weight | 409.09 g/mol |
| LogP | 5.20814 |
| Topological Polar Surface Area | 60.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.09186 |
| Heavy Atoms | 28 |
| Complexity | 1186.342 |
Chemical Identifiers
| CAS Number | 379247-90-2 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)CSC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2CC=C |
Product Overview
AF-399/15539089 (CAS 379247-90-2), with molecular formula C21H19N3O2S2 and molecular weight 409.09 g/mol. IUPAC: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-6-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AF-399/15539089
Property Insights of AF-399/15539089
The XLogP value of 5.20814 indicates that AF-399/15539089 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.92 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15539089. Following Lipinski's Rule of Five, AF-399/15539089 has 0 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 AF-399/15539089?
The CAS number of AF-399/15539089 is 379247-90-2.
What is the molecular formula of AF-399/15539089?
The molecular formula of AF-399/15539089 is C21H19N3O2S2.
What is the molecular weight of AF-399/15539089?
The molecular weight of AF-399/15539089 is 409.09 g/mol.
Where can I buy AF-399/15539089?
You can request a quote for AF-399/15539089 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15539089?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15539089 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.