ChemDiv3_005659
TL;DR: ChemDiv3_005659 (CAS 1005127-96-7) is a chemical compound with molecular formula C23H18ClNO2 and molecular weight 375.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-chlorophenyl)-6,6a,7,11b-tetrahydro-5H-indeno[2,1-c]quinoline-2-carboxylic acid
Also Known As: ChemDiv3_005659, IDI1_023569, 6-(3-chlorophenyl)-6,6a,7,11b-tetrahydro-5H-indeno[2,1-c]quinoline-2-carboxylic acid
| Molecular Formula | C23H18ClNO2 |
|---|---|
| Molecular Weight | 375.10 g/mol |
| LogP | 5.5092 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.1026 |
| Heavy Atoms | 27 |
| Complexity | 1061.7489 |
Chemical Identifiers
| CAS Number | 1005127-96-7 |
|---|---|
| SMILES | C1C2C(C3=CC=CC=C31)C4=C(C=CC(=C4)C(=O)O)NC2C5=CC(=CC=C5)Cl |
Product Overview
ChemDiv3_005659 (CAS 1005127-96-7), with molecular formula C23H18ClNO2 and molecular weight 375.10 g/mol. IUPAC: 6-(3-chlorophenyl)-6,6a,7,11b-tetrahydro-5H-indeno[2,1-c]quinoline-2-carboxylic acid.
Chemical Property Profile of ChemDiv3_005659
Property Insights of ChemDiv3_005659
The XLogP value of 5.5092 indicates that ChemDiv3_005659 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, ChemDiv3_005659 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_005659 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv3_005659?
The CAS number of ChemDiv3_005659 is 1005127-96-7.
What is the molecular formula of ChemDiv3_005659?
The molecular formula of ChemDiv3_005659 is C23H18ClNO2.
What is the molecular weight of ChemDiv3_005659?
The molecular weight of ChemDiv3_005659 is 375.10 g/mol.
Where can I buy ChemDiv3_005659?
You can request a quote for ChemDiv3_005659 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_005659?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_005659 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.