ChemDiv1_023792
TL;DR: ChemDiv1_023792 (CAS 499100-80-0) is a chemical compound with molecular formula C27H18ClNO5 and molecular weight 471.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-chloro-2-methylphenyl)-1-phenylspiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
Also Known As: ChemDiv1_023792, BAS 00916108, 5-(3-chloro-2-methylphenyl)-3-phenyl-3a,6a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(3H,5H)-tetrone, 5-(3-chloro-2-methylphenyl)-3-phenyl-3,3a-dihydrospiro[furo[3,4-c]pyrrole-1,2'-indene]-1',3',4,6(5H,6aH)-tetraone, 2-(3-chloro-2-methylphenyl)-4-phenylspiro[2,4,5,6,3a,6a-hexahydro-5-oxa-2-azap entalene-6,2'-2-hydrocyclopenta[1,2-a]benzene]-1,3,9,11-tetraone
| Molecular Formula | C27H18ClNO5 |
|---|---|
| Molecular Weight | 471.09 g/mol |
| LogP | 4.34352 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 471.08734 |
| Heavy Atoms | 34 |
| Complexity | 1380.5277 |
Chemical Identifiers
| CAS Number | 499100-80-0 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)N2C(=O)C3C(C2=O)C4(C(=O)C5=CC=CC=C5C4=O)OC3C6=CC=CC=C6 |
Product Overview
ChemDiv1_023792 (CAS 499100-80-0), with molecular formula C27H18ClNO5 and molecular weight 471.09 g/mol. IUPAC: 5-(3-chloro-2-methylphenyl)-1-phenylspiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone.
Chemical Property Profile of ChemDiv1_023792
Property Insights of ChemDiv1_023792
The XLogP value of 4.34352 indicates that ChemDiv1_023792 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_023792. Following Lipinski's Rule of Five, ChemDiv1_023792 has 0 hydrogen bond donor(s) and 5 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_023792?
The CAS number of ChemDiv1_023792 is 499100-80-0.
What is the molecular formula of ChemDiv1_023792?
The molecular formula of ChemDiv1_023792 is C27H18ClNO5.
What is the molecular weight of ChemDiv1_023792?
The molecular weight of ChemDiv1_023792 is 471.09 g/mol.
Where can I buy ChemDiv1_023792?
You can request a quote for ChemDiv1_023792 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023792?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023792 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.