BAS 09587810
TL;DR: BAS 09587810 (CAS 442654-59-3) is a chemical compound with molecular formula C16H18ClNO5S and molecular weight 371.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-(5-chlorothiophen-2-yl)-1-(2-methoxyethyl)-4H-pyridine-3,5-dicarboxylate
Also Known As: BAS 09587810, A2825/0119310, dimethyl 4-(5-chlorothiophen-2-yl)-1-(2-methoxyethyl)-1,4-dihydropyridine-3,5-dicarboxylate, dimethyl 4-(5-chlorothiophen-2-yl)-1-(2-methoxyethyl)-4H-pyridine-3,5-dicarboxylate, 3,5-DIMETHYL 4-(5-CHLOROTHIOPHEN-2-YL)-1-(2-METHOXYETHYL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
| Molecular Formula | C16H18ClNO5S |
|---|---|
| Molecular Weight | 371.06 g/mol |
| LogP | 2.5609 |
| Topological Polar Surface Area | 65.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 371.05942 |
| Heavy Atoms | 24 |
| Complexity | 647.7626 |
Chemical Identifiers
| CAS Number | 442654-59-3 |
|---|---|
| SMILES | COCCN1C=C(C(C(=C1)C(=O)OC)C2=CC=C(S2)Cl)C(=O)OC |
Product Overview
BAS 09587810 (CAS 442654-59-3), with molecular formula C16H18ClNO5S and molecular weight 371.06 g/mol. IUPAC: dimethyl 4-(5-chlorothiophen-2-yl)-1-(2-methoxyethyl)-4H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of BAS 09587810
Property Insights of BAS 09587810
The XLogP value of 2.5609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09587810. The TPSA of 65.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09587810. Following Lipinski's Rule of Five, BAS 09587810 has 0 hydrogen bond donor(s) and 7 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 09587810?
The CAS number of BAS 09587810 is 442654-59-3.
What is the molecular formula of BAS 09587810?
The molecular formula of BAS 09587810 is C16H18ClNO5S.
What is the molecular weight of BAS 09587810?
The molecular weight of BAS 09587810 is 371.06 g/mol.
Where can I buy BAS 09587810?
You can request a quote for BAS 09587810 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09587810?
Yes, KEHONG BIO provides custom synthesis services for BAS 09587810 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.