BAS 00381253
TL;DR: BAS 00381253 (CAS 76258-19-0) is a chemical compound with molecular formula C20H23N3O7 and molecular weight 417.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-O-[2-[formyl(methyl)amino]ethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: BAS 00381253, 2-[formyl(methyl)amino]ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 2-(N-methylcarbonylamino)ethyl 5-(methoxycarbonyl)-2,6-dimethyl-4-(3-nitrophen yl)-1,4-dihydropyridine-3-carboxylate, 3-methyl 5-(2-(N-methylformamido)ethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 3-METHYL 5-[2-(N-METHYLFORMAMIDO)ETHYL] 2,6-DIMETHYL-4-(3-NITROPHENYL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
| Molecular Formula | C20H23N3O7 |
|---|---|
| Molecular Weight | 417.15 g/mol |
| LogP | 1.634 |
| Topological Polar Surface Area | 128.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 417.1536 |
| Heavy Atoms | 30 |
| Complexity | 936.0827 |
Chemical Identifiers
| CAS Number | 76258-19-0 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OCCN(C)C=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC |
Product Overview
BAS 00381253 (CAS 76258-19-0), with molecular formula C20H23N3O7 and molecular weight 417.15 g/mol. IUPAC: 5-O-[2-[formyl(methyl)amino]ethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of BAS 00381253
Property Insights of BAS 00381253
The XLogP value of 1.634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00381253. The TPSA of 128.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00381253. Following Lipinski's Rule of Five, BAS 00381253 has 1 hydrogen bond donor(s) and 8 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 BAS 00381253?
The CAS number of BAS 00381253 is 76258-19-0.
What is the molecular formula of BAS 00381253?
The molecular formula of BAS 00381253 is C20H23N3O7.
What is the molecular weight of BAS 00381253?
The molecular weight of BAS 00381253 is 417.15 g/mol.
Where can I buy BAS 00381253?
You can request a quote for BAS 00381253 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00381253?
Yes, KEHONG BIO provides custom synthesis services for BAS 00381253 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.