TOS-BB-0495
TL;DR: TOS-BB-0495 (CAS 354812-77-4) 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-(4-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid
Also Known As: TOS-BB-0495, BAS 00785738, 4-(4-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid, 4-(4-Chloro-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic, 4-(4-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 | 797.51697 |
Chemical Identifiers
| CAS Number | 354812-77-4 |
|---|---|
| SMILES | C1C=CC2C1C(NC3=C2C=C(C=C3)C(=O)O)C4=CC=C(C=C4)Cl |
Product Overview
TOS-BB-0495 (CAS 354812-77-4), with molecular formula C19H16ClNO2 and molecular weight 325.09 g/mol. IUPAC: 4-(4-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid.
Chemical Property Profile of TOS-BB-0495
Property Insights of TOS-BB-0495
The XLogP value of 4.8647 indicates that TOS-BB-0495 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, TOS-BB-0495 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TOS-BB-0495 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 TOS-BB-0495?
The CAS number of TOS-BB-0495 is 354812-77-4.
What is the molecular formula of TOS-BB-0495?
The molecular formula of TOS-BB-0495 is C19H16ClNO2.
What is the molecular weight of TOS-BB-0495?
The molecular weight of TOS-BB-0495 is 325.09 g/mol.
Where can I buy TOS-BB-0495?
You can request a quote for TOS-BB-0495 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TOS-BB-0495?
Yes, KEHONG BIO provides custom synthesis services for TOS-BB-0495 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.