BAS 00444429
TL;DR: BAS 00444429 (CAS 467446-52-2) is a chemical compound with molecular formula C19H16ClNO2 and molecular weight 325.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid
Also Known As: BAS 00444429, AB00086553-01, 4-(2-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid, 4-(2-Chloro-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic, 4-(2-chlorophenyl)-3,4,5,3a,9b-pentahydrocyclopenta[1,2-c]quinoline-8-carboxyl ic acid
| Molecular Formula | C19H16ClNO2 |
|---|---|
| Molecular Weight | 325.09 g/mol |
| LogP | 4.8647 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.08694 |
| Heavy Atoms | 23 |
| Complexity | 814.76697 |
Chemical Identifiers
| CAS Number | 467446-52-2 |
|---|---|
| SMILES | C1C=CC2C1C(NC3=C2C=C(C=C3)C(=O)O)C4=CC=CC=C4Cl |
Product Overview
BAS 00444429 (CAS 467446-52-2), with molecular formula C19H16ClNO2 and molecular weight 325.09 g/mol. IUPAC: 4-(2-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid.
Chemical Property Profile of BAS 00444429
Property Insights of BAS 00444429
The XLogP value of 4.8647 indicates that BAS 00444429 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, BAS 00444429 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00444429 has 2 hydrogen bond donor(s) and 2 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 00444429?
The CAS number of BAS 00444429 is 467446-52-2.
What is the molecular formula of BAS 00444429?
The molecular formula of BAS 00444429 is C19H16ClNO2.
What is the molecular weight of BAS 00444429?
The molecular weight of BAS 00444429 is 325.09 g/mol.
Where can I buy BAS 00444429?
You can request a quote for BAS 00444429 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00444429?
Yes, KEHONG BIO provides custom synthesis services for BAS 00444429 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.