BAS 04378936
TL;DR: BAS 04378936 (CAS 400067-89-2) is a chemical compound with molecular formula C22H25NO7 and molecular weight 415.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-(4-methoxycarbonylphenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate
Also Known As: BAS 04378936, dimethyl 4-[4-(methoxycarbonyl)phenyl]-1-(tetrahydrofuran-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate, dimethyl 4-(4-methoxycarbonylphenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate, methyl 4-[3,5-bis(methoxycarbonyl)-1-(oxolan-2-ylmethyl)-4-1,4-dihydropyridyl] benzoate, dimethyl 4-(4-(methoxycarbonyl)phenyl)-1-((tetrahydrofuran-2-yl)methyl)-1,4-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C22H25NO7 |
|---|---|
| Molecular Weight | 415.16 g/mol |
| LogP | 2.1652 |
| Topological Polar Surface Area | 91.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.16312 |
| Heavy Atoms | 30 |
| Complexity | 831.9772 |
Chemical Identifiers
| CAS Number | 400067-89-2 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2C(=CN(C=C2C(=O)OC)CC3CCCO3)C(=O)OC |
Product Overview
BAS 04378936 (CAS 400067-89-2), with molecular formula C22H25NO7 and molecular weight 415.16 g/mol. IUPAC: dimethyl 4-(4-methoxycarbonylphenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of BAS 04378936
Property Insights of BAS 04378936
The XLogP value of 2.1652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04378936. The TPSA of 91.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04378936. Following Lipinski's Rule of Five, BAS 04378936 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 04378936?
The CAS number of BAS 04378936 is 400067-89-2.
What is the molecular formula of BAS 04378936?
The molecular formula of BAS 04378936 is C22H25NO7.
What is the molecular weight of BAS 04378936?
The molecular weight of BAS 04378936 is 415.16 g/mol.
Where can I buy BAS 04378936?
You can request a quote for BAS 04378936 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04378936?
Yes, KEHONG BIO provides custom synthesis services for BAS 04378936 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.