BAS 04378979
TL;DR: BAS 04378979 (CAS 421571-20-2) is a chemical compound with molecular formula C20H21Cl2NO5 and molecular weight 425.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-(3,4-dichlorophenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate
Also Known As: BAS 04378979, A2647/0112762, dimethyl 4-(3,4-dichlorophenyl)-1-(tetrahydrofuran-2-ylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate, dimethyl 4-(3,4-dichlorophenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate, 3,5-DIMETHYL 4-(3,4-DICHLOROPHENYL)-1-[(OXOLAN-2-YL)METHYL]-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
| Molecular Formula | C20H21Cl2NO5 |
|---|---|
| Molecular Weight | 425.08 g/mol |
| LogP | 3.6854 |
| Topological Polar Surface Area | 65.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.07968 |
| Heavy Atoms | 28 |
| Complexity | 795.885 |
Chemical Identifiers
| CAS Number | 421571-20-2 |
|---|---|
| SMILES | COC(=O)C1=CN(C=C(C1C2=CC(=C(C=C2)Cl)Cl)C(=O)OC)CC3CCCO3 |
Product Overview
BAS 04378979 (CAS 421571-20-2), with molecular formula C20H21Cl2NO5 and molecular weight 425.08 g/mol. IUPAC: dimethyl 4-(3,4-dichlorophenyl)-1-(oxolan-2-ylmethyl)-4H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of BAS 04378979
Property Insights of BAS 04378979
The XLogP value of 3.6854 indicates that BAS 04378979 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04378979. Following Lipinski's Rule of Five, BAS 04378979 has 0 hydrogen bond donor(s) and 6 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 04378979?
The CAS number of BAS 04378979 is 421571-20-2.
What is the molecular formula of BAS 04378979?
The molecular formula of BAS 04378979 is C20H21Cl2NO5.
What is the molecular weight of BAS 04378979?
The molecular weight of BAS 04378979 is 425.08 g/mol.
Where can I buy BAS 04378979?
You can request a quote for BAS 04378979 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04378979?
Yes, KEHONG BIO provides custom synthesis services for BAS 04378979 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.