ChemDiv1_002349
TL;DR: ChemDiv1_002349 (CAS 316187-23-2) is a chemical compound with molecular formula C23H23BrN2O2 and molecular weight 438.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-bromophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-yl]-morpholin-4-ylmethanone
Also Known As: ChemDiv1_002349, 4-(4-bromophenyl)-6-(4-morpholinylcarbonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline, (4-(4-bromophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-yl)(morpholino)methanone, [4-(4-bromophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-yl](morpholin-4-yl)methanone, [4-(4-bromophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-yl]-morpholin-4-ylmethanone
| Molecular Formula | C23H23BrN2O2 |
|---|---|
| Molecular Weight | 438.09 g/mol |
| LogP | 4.748 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 438.0943 |
| Heavy Atoms | 28 |
| Complexity | 918.6996 |
Chemical Identifiers
| CAS Number | 316187-23-2 |
|---|---|
| SMILES | C1COCCN1C(=O)C2=CC=CC3=C2NC(C4C3C=CC4)C5=CC=C(C=C5)Br |
Product Overview
ChemDiv1_002349 (CAS 316187-23-2), with molecular formula C23H23BrN2O2 and molecular weight 438.09 g/mol. IUPAC: [4-(4-bromophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-yl]-morpholin-4-ylmethanone.
Chemical Property Profile of ChemDiv1_002349
Property Insights of ChemDiv1_002349
The XLogP value of 4.748 indicates that ChemDiv1_002349 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, ChemDiv1_002349 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_002349 has 1 hydrogen bond donor(s) and 3 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 ChemDiv1_002349?
The CAS number of ChemDiv1_002349 is 316187-23-2.
What is the molecular formula of ChemDiv1_002349?
The molecular formula of ChemDiv1_002349 is C23H23BrN2O2.
What is the molecular weight of ChemDiv1_002349?
The molecular weight of ChemDiv1_002349 is 438.09 g/mol.
Where can I buy ChemDiv1_002349?
You can request a quote for ChemDiv1_002349 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002349?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002349 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.