ChemDiv1_002704
TL;DR: ChemDiv1_002704 (CAS 355115-30-9) is a chemical compound with molecular formula C21H19Cl2NO2 and molecular weight 387.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2,4-dichlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate
Also Known As: ChemDiv1_002704, BAS 01123459, BIM-0036075.P001, ethyl 4-(2,4-dichlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate, ethyl 4-(2,4-dichlorophenyl)-3,4,5,3a,9b-pentahydrocyclopenta[1,2-c]quinoline- 8-carboxylate
| Molecular Formula | C21H19Cl2NO2 |
|---|---|
| Molecular Weight | 387.08 g/mol |
| LogP | 5.9966 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.07928 |
| Heavy Atoms | 26 |
| Complexity | 893.57495 |
Chemical Identifiers
| CAS Number | 355115-30-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=C(C=C(C=C4)Cl)Cl |
Product Overview
ChemDiv1_002704 (CAS 355115-30-9), with molecular formula C21H19Cl2NO2 and molecular weight 387.08 g/mol. IUPAC: ethyl 4-(2,4-dichlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate.
Chemical Property Profile of ChemDiv1_002704
Property Insights of ChemDiv1_002704
The XLogP value of 5.9966 indicates that ChemDiv1_002704 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, ChemDiv1_002704 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_002704 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_002704?
The CAS number of ChemDiv1_002704 is 355115-30-9.
What is the molecular formula of ChemDiv1_002704?
The molecular formula of ChemDiv1_002704 is C21H19Cl2NO2.
What is the molecular weight of ChemDiv1_002704?
The molecular weight of ChemDiv1_002704 is 387.08 g/mol.
Where can I buy ChemDiv1_002704?
You can request a quote for ChemDiv1_002704 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002704?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002704 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.