BAS 00245853
TL;DR: BAS 00245853 (CAS 71941-45-2) is a chemical compound with molecular formula C26H28N2O7 and molecular weight 480.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate
Also Known As: BAS 00245853, 3,5-diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 1,4-Dihydro-1-(4-methoxyphenyl)-4-(3-nitrophenyl)-2,6-dimethylpyridine-3,5-dicarboxylic acid diethyl ester, 2,6-Dimethyl-1,4-dihydro-4-(3-nitrophenyl)-1-(4-methoxyphenyl)pyridine-3,5-dicarboxylic acid diethyl ester
| Molecular Formula | C26H28N2O7 |
|---|---|
| Molecular Weight | 480.19 g/mol |
| LogP | 4.8814 |
| Topological Polar Surface Area | 108.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 480.18964 |
| Heavy Atoms | 35 |
| Complexity | 1156.4359 |
Chemical Identifiers
| CAS Number | 71941-45-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)C3=CC=C(C=C3)OC)C |
Product Overview
BAS 00245853 (CAS 71941-45-2), with molecular formula C26H28N2O7 and molecular weight 480.19 g/mol. IUPAC: diethyl 1-(4-methoxyphenyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of BAS 00245853
Property Insights of BAS 00245853
The XLogP value of 4.8814 indicates that BAS 00245853 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.21 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00245853. Following Lipinski's Rule of Five, BAS 00245853 has 0 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 00245853?
The CAS number of BAS 00245853 is 71941-45-2.
What is the molecular formula of BAS 00245853?
The molecular formula of BAS 00245853 is C26H28N2O7.
What is the molecular weight of BAS 00245853?
The molecular weight of BAS 00245853 is 480.19 g/mol.
Where can I buy BAS 00245853?
You can request a quote for BAS 00245853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00245853?
Yes, KEHONG BIO provides custom synthesis services for BAS 00245853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.