(3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
TL;DR: (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione (CAS 1008263-67-9) is a chemical compound with molecular formula C23H25NO3 and molecular weight 363.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-cyclohexylidene-4-(4-ethoxyphenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione, 8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
| Molecular Formula | C23H25NO3 |
|---|---|
| Molecular Weight | 363.18 g/mol |
| LogP | 4.2674 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.18344 |
| Heavy Atoms | 27 |
| Complexity | 808.8794 |
Chemical Identifiers
| CAS Number | 1008263-67-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)C4=C5CCCCC5 |
Product Overview
(3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione (CAS 1008263-67-9), with molecular formula C23H25NO3 and molecular weight 363.18 g/mol. IUPAC: 10-cyclohexylidene-4-(4-ethoxyphenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Property Insights of (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
The XLogP value of 4.2674 indicates that (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione has 0 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 (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The CAS number of (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is 1008263-67-9.
What is the molecular formula of (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The molecular formula of (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is C23H25NO3.
What is the molecular weight of (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
The molecular weight of (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione is 363.18 g/mol.
Where can I buy (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
You can request a quote for (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (3aR,4R,7S,7aS)-8-cyclohexylidene-2-(4-ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.