F0291-0218
TL;DR: F0291-0218 (CAS 364744-80-9) is a chemical compound with molecular formula C16H15N3O5S and molecular weight 361.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[5-cyano-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate
Also Known As: F0291-0218, ethyl {[3-cyano-6-hydroxy-4-(2-nitrophenyl)-4,5-dihydropyridin-2-yl]sulfanyl}acetate, ethyl 2-((3-cyano-4-(2-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)acetate, ethyl 2-{[3-cyano-4-(2-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate, ethyl 2-[[5-cyano-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate
| Molecular Formula | C16H15N3O5S |
|---|---|
| Molecular Weight | 361.07 g/mol |
| LogP | 2.22978 |
| Topological Polar Surface Area | 122.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.07324 |
| Heavy Atoms | 25 |
| Complexity | 784.22003 |
Chemical Identifiers
| CAS Number | 364744-80-9 |
|---|---|
| SMILES | CCOC(=O)CSC1=C(C(CC(=O)N1)C2=CC=CC=C2[N+](=O)[O-])C#N |
Product Overview
F0291-0218 (CAS 364744-80-9), with molecular formula C16H15N3O5S and molecular weight 361.07 g/mol. IUPAC: ethyl 2-[[5-cyano-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetate.
Chemical Property Profile of F0291-0218
Property Insights of F0291-0218
The XLogP value of 2.22978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0291-0218. The TPSA of 122.33 Ų falls within the moderate polarity range, balancing permeability and solubility for F0291-0218. Following Lipinski's Rule of Five, F0291-0218 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 F0291-0218?
The CAS number of F0291-0218 is 364744-80-9.
What is the molecular formula of F0291-0218?
The molecular formula of F0291-0218 is C16H15N3O5S.
What is the molecular weight of F0291-0218?
The molecular weight of F0291-0218 is 361.07 g/mol.
Where can I buy F0291-0218?
You can request a quote for F0291-0218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0291-0218?
Yes, KEHONG BIO provides custom synthesis services for F0291-0218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.