1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-
TL;DR: 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- (CAS 61330-03-8) is a chemical compound with molecular formula C14H13ClFNO2 and molecular weight 281.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2-fluorophenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Also Known As: Pyrido<3,2-e>as-triazin, 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-, 2-(4-chloro-2-fluorophenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-1H-isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluoro-phenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
| Molecular Formula | C14H13ClFNO2 |
|---|---|
| Molecular Weight | 281.06 g/mol |
| LogP | 3.1587 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.0619 |
| Heavy Atoms | 19 |
| Complexity | 536.377 |
Chemical Identifiers
| CAS Number | 61330-03-8 |
|---|---|
| SMILES | C1CCC2C(C1)C(=O)N(C2=O)C3=C(C=C(C=C3)Cl)F |
Product Overview
1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- (CAS 61330-03-8), with molecular formula C14H13ClFNO2 and molecular weight 281.06 g/mol. IUPAC: 2-(4-chloro-2-fluorophenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione.
Chemical Property Profile of 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-
Property Insights of 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-
The XLogP value of 3.1587 indicates that 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- has 0 hydrogen bond donor(s) and 2 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 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-?
The CAS number of 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- is 61330-03-8.
What is the molecular formula of 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-?
The molecular formula of 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- is C14H13ClFNO2.
What is the molecular weight of 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-?
The molecular weight of 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- is 281.06 g/mol.
Where can I buy 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-?
You can request a quote for 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Isoindole-1,3(2H)-dione, 2-(4-chloro-2-fluorophenyl)hexahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.