N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
TL;DR: N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide (CAS 6208-65-7) is a chemical compound with molecular formula C31H40Cl2N4O4 and molecular weight 602.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-cyclohexyl-6-N-(3,4-dichlorophenyl)-3-[2-(2-ethylpiperidin-1-yl)ethyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide
Also Known As: N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
| Molecular Formula | C31H40Cl2N4O4 |
|---|---|
| Molecular Weight | 602.24 g/mol |
| LogP | 4.7959 |
| Topological Polar Surface Area | 90.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 602.2427 |
| Heavy Atoms | 41 |
| Complexity | 1220.4983 |
Chemical Identifiers
| CAS Number | 6208-65-7 |
|---|---|
| SMILES | CCC1CCCCN1CCN2C(C34C=CC(O3)C(C4C2=O)C(=O)NC5=CC(=C(C=C5)Cl)Cl)C(=O)NC6CCCCC6 |
Product Overview
N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide (CAS 6208-65-7), with molecular formula C31H40Cl2N4O4 and molecular weight 602.24 g/mol. IUPAC: 2-N-cyclohexyl-6-N-(3,4-dichlorophenyl)-3-[2-(2-ethylpiperidin-1-yl)ethyl]-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide.
Chemical Property Profile of N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
Property Insights of N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide
The XLogP value of 4.7959 indicates that N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.98 Ų falls within the moderate polarity range, balancing permeability and solubility for N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide. Following Lipinski's Rule of Five, N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide?
The CAS number of N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide is 6208-65-7.
What is the molecular formula of N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide?
The molecular formula of N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide is C31H40Cl2N4O4.
What is the molecular weight of N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide?
The molecular weight of N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide is 602.24 g/mol.
Where can I buy N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide?
You can request a quote for N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N~3~-cyclohexyl-N~7~-(3,4-dichlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-3,7-dicarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.