BAS 01404210
TL;DR: BAS 01404210 (CAS 312586-14-4) is a chemical compound with molecular formula C31H27Cl2NO4 and molecular weight 547.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenoxyethyl 4,7-bis(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01404210, 2-phenoxyethyl 4,7-bis(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-phenoxyethyl 4,7-bis(4-chlorophenyl)-2-methyl-5-oxo-1,4,6,7,8-pentahydroquin oline-3-carboxylate, 2-phenoxyethyl 4,7-bis(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C31H27Cl2NO4 |
|---|---|
| Molecular Weight | 547.13 g/mol |
| LogP | 6.9772 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 547.1317 |
| Heavy Atoms | 38 |
| Complexity | 1396.0568 |
Chemical Identifiers
| CAS Number | 312586-14-4 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)C(=O)OCCOC5=CC=CC=C5 |
Product Overview
BAS 01404210 (CAS 312586-14-4), with molecular formula C31H27Cl2NO4 and molecular weight 547.13 g/mol. IUPAC: 2-phenoxyethyl 4,7-bis(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01404210
Property Insights of BAS 01404210
The XLogP value of 6.9772 indicates that BAS 01404210 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01404210. Following Lipinski's Rule of Five, BAS 01404210 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01404210?
The CAS number of BAS 01404210 is 312586-14-4.
What is the molecular formula of BAS 01404210?
The molecular formula of BAS 01404210 is C31H27Cl2NO4.
What is the molecular weight of BAS 01404210?
The molecular weight of BAS 01404210 is 547.13 g/mol.
Where can I buy BAS 01404210?
You can request a quote for BAS 01404210 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404210?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404210 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.