ChemDiv1_025345
TL;DR: ChemDiv1_025345 (CAS 359764-60-6) is a chemical compound with molecular formula C33H29NO3 and molecular weight 487.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(4-phenylphenyl)ethyl] 1-azapentacyclo[10.6.1.03,7.08,19.013,17]nonadeca-5,8,10,12(19),14-pentaene-10-carboxylate
Also Known As: ChemDiv1_025345, 2-(biphenyl-4-yl)-2-oxoethyl 3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinoline-2-carboxylate, 2-([1,1'-biphenyl]-4-yl)-2-oxoethyl 3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[4,5]pyrido[3,2,1-ij]cyclopenta[c]quinoline-2-carboxylate
| Molecular Formula | C33H29NO3 |
|---|---|
| Molecular Weight | 487.21 g/mol |
| LogP | 6.5463 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 487.21475 |
| Heavy Atoms | 37 |
| Complexity | 1385.1449 |
Chemical Identifiers
| CAS Number | 359764-60-6 |
|---|---|
| SMILES | C1C=CC2C1CN3CC4CC=CC4C5=C3C2=CC(=C5)C(=O)OCC(=O)C6=CC=C(C=C6)C7=CC=CC=C7 |
Product Overview
ChemDiv1_025345 (CAS 359764-60-6), with molecular formula C33H29NO3 and molecular weight 487.21 g/mol. IUPAC: [2-oxo-2-(4-phenylphenyl)ethyl] 1-azapentacyclo[10.6.1.03,7.08,19.013,17]nonadeca-5,8,10,12(19),14-pentaene-10-carboxylate.
Chemical Property Profile of ChemDiv1_025345
Property Insights of ChemDiv1_025345
The XLogP value of 6.5463 indicates that ChemDiv1_025345 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, ChemDiv1_025345 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_025345 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_025345?
The CAS number of ChemDiv1_025345 is 359764-60-6.
What is the molecular formula of ChemDiv1_025345?
The molecular formula of ChemDiv1_025345 is C33H29NO3.
What is the molecular weight of ChemDiv1_025345?
The molecular weight of ChemDiv1_025345 is 487.21 g/mol.
Where can I buy ChemDiv1_025345?
You can request a quote for ChemDiv1_025345 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_025345?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_025345 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.