BIM-0044153.P001
TL;DR: BIM-0044153.P001 (CAS 312697-90-8) is a chemical compound with molecular formula C21H20N2O5 and molecular weight 380.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 6-methyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
Also Known As: BIM-0044153.P001, A2439/0103349, 2-phenylethyl 2-methyl-4-(2-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate, 2-phenylethyl 2-methyl-4-(2-nitrophenyl)-6-oxo-1,4,5-trihydropyridine-3-carbox ylate, phenethyl 2-methyl-4-(2-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
| Molecular Formula | C21H20N2O5 |
|---|---|
| Molecular Weight | 380.14 g/mol |
| LogP | 3.2582 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.1372 |
| Heavy Atoms | 28 |
| Complexity | 936.82196 |
Chemical Identifiers
| CAS Number | 312697-90-8 |
|---|---|
| SMILES | CC1=C(C(CC(=O)N1)C2=CC=CC=C2[N+](=O)[O-])C(=O)OCCC3=CC=CC=C3 |
Product Overview
BIM-0044153.P001 (CAS 312697-90-8), with molecular formula C21H20N2O5 and molecular weight 380.14 g/mol. IUPAC: 2-phenylethyl 6-methyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate.
Chemical Property Profile of BIM-0044153.P001
Property Insights of BIM-0044153.P001
The XLogP value of 3.2582 indicates that BIM-0044153.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0044153.P001. Following Lipinski's Rule of Five, BIM-0044153.P001 has 1 hydrogen bond donor(s) and 5 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-0044153.P001?
The CAS number of BIM-0044153.P001 is 312697-90-8.
What is the molecular formula of BIM-0044153.P001?
The molecular formula of BIM-0044153.P001 is C21H20N2O5.
What is the molecular weight of BIM-0044153.P001?
The molecular weight of BIM-0044153.P001 is 380.14 g/mol.
Where can I buy BIM-0044153.P001?
You can request a quote for BIM-0044153.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0044153.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0044153.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.