AF-399/14605019
TL;DR: AF-399/14605019 (CAS 325693-54-7) is a chemical compound with molecular formula C16H18N2O3S2 and molecular weight 350.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(16-oxo-8,12-dithia-10,15-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),10-trien-14-yl)acetate
Also Known As: AF-399/14605019, ethyl (5-oxo-2,3,6,7,8,9-hexahydro-5H-[1]benzothieno[2,3-d][1,3]thiazolo[3,2-a]pyrimidin-3-yl)acetate, ethyl 2-(16-oxo-8,12-dithia-10,15-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),10-trien-14-yl)acetate, ethyl 2-(5-oxo-3,5,6,7,8,9-hexahydro-2H-benzo[4,5]thieno[2,3-d]thiazolo[3,2-a]pyrimidin-3-yl)acetate, ethyl 2-(5-oxo-4,6,7,8,9-pentahydro-2H,3H-benzo[b]thiopheno[2,3-d]1,3-thiazoli dino[3,2-a]pyrimidin-3-yl)acetate
| Molecular Formula | C16H18N2O3S2 |
|---|---|
| Molecular Weight | 350.08 g/mol |
| LogP | 2.9368 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.0759 |
| Heavy Atoms | 23 |
| Complexity | 839.9434 |
Chemical Identifiers
| CAS Number | 325693-54-7 |
|---|---|
| SMILES | CCOC(=O)CC1CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N12 |
Product Overview
AF-399/14605019 (CAS 325693-54-7), with molecular formula C16H18N2O3S2 and molecular weight 350.08 g/mol. IUPAC: ethyl 2-(16-oxo-8,12-dithia-10,15-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),10-trien-14-yl)acetate.
Chemical Property Profile of AF-399/14605019
Property Insights of AF-399/14605019
The XLogP value of 2.9368 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/14605019. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/14605019. Following Lipinski's Rule of Five, AF-399/14605019 has 0 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-399/14605019?
The CAS number of AF-399/14605019 is 325693-54-7.
What is the molecular formula of AF-399/14605019?
The molecular formula of AF-399/14605019 is C16H18N2O3S2.
What is the molecular weight of AF-399/14605019?
The molecular weight of AF-399/14605019 is 350.08 g/mol.
Where can I buy AF-399/14605019?
You can request a quote for AF-399/14605019 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/14605019?
Yes, KEHONG BIO provides custom synthesis services for AF-399/14605019 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.