BIM-0043847.P001
TL;DR: BIM-0043847.P001 (CAS 370075-42-6) 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 5-cyano-6-methylsulfanyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate
Also Known As: BIM-0043847.P001, ethyl 5-cyano-6-(methylthio)-4-(2-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate, ethyl 5-cyano-6-(methylsulfanyl)-4-(2-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate, F0894-0316, ethyl 5-cyano-6-methylsulfanyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate
| Molecular Formula | C16H15N3O5S |
|---|---|
| Molecular Weight | 361.07 g/mol |
| LogP | 2.08568 |
| Topological Polar Surface Area | 122.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.07324 |
| Heavy Atoms | 25 |
| Complexity | 799.2051 |
Chemical Identifiers
| CAS Number | 370075-42-6 |
|---|---|
| SMILES | CCOC(=O)C1C(C(=C(NC1=O)SC)C#N)C2=CC=CC=C2[N+](=O)[O-] |
Product Overview
BIM-0043847.P001 (CAS 370075-42-6), with molecular formula C16H15N3O5S and molecular weight 361.07 g/mol. IUPAC: ethyl 5-cyano-6-methylsulfanyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate.
Chemical Property Profile of BIM-0043847.P001
Property Insights of BIM-0043847.P001
The XLogP value of 2.08568 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0043847.P001. The TPSA of 122.33 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0043847.P001. Following Lipinski's Rule of Five, BIM-0043847.P001 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 BIM-0043847.P001?
The CAS number of BIM-0043847.P001 is 370075-42-6.
What is the molecular formula of BIM-0043847.P001?
The molecular formula of BIM-0043847.P001 is C16H15N3O5S.
What is the molecular weight of BIM-0043847.P001?
The molecular weight of BIM-0043847.P001 is 361.07 g/mol.
Where can I buy BIM-0043847.P001?
You can request a quote for BIM-0043847.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0043847.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0043847.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.