BAS 00364511
TL;DR: BAS 00364511 (CAS 181480-19-3) is a chemical compound with molecular formula C21H24ClNO3 and molecular weight 373.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00364511, UPCMLD0ENAT0400-0891:001, J2.207.432F, ethyl 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, ethyl 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C21H24ClNO3 |
|---|---|
| Molecular Weight | 373.14 g/mol |
| LogP | 4.5071 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.14447 |
| Heavy Atoms | 26 |
| Complexity | 818.1629 |
Chemical Identifiers
| CAS Number | 181480-19-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)Cl)C(=O)CC(C2)(C)C)C |
Product Overview
BAS 00364511 (CAS 181480-19-3), with molecular formula C21H24ClNO3 and molecular weight 373.14 g/mol. IUPAC: ethyl 4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00364511
Property Insights of BAS 00364511
The XLogP value of 4.5071 indicates that BAS 00364511 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 00364511 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00364511 has 1 hydrogen bond donor(s) and 4 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 00364511?
The CAS number of BAS 00364511 is 181480-19-3.
What is the molecular formula of BAS 00364511?
The molecular formula of BAS 00364511 is C21H24ClNO3.
What is the molecular weight of BAS 00364511?
The molecular weight of BAS 00364511 is 373.14 g/mol.
Where can I buy BAS 00364511?
You can request a quote for BAS 00364511 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00364511?
Yes, KEHONG BIO provides custom synthesis services for BAS 00364511 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.