![Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate structure](/static/products/2844/28443-85-8.webp)
Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate
TL;DR: Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate (CAS 28443-85-8) is a chemical compound with molecular formula C31H36N2O2 and molecular weight 468.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 12-cyclohexyl-8-cyclohexylimino-1-phenyl-12-azatricyclo[7.2.1.02,7]dodeca-2,4,6,10-tetraene-11-carboxylate
Also Known As: Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate, Methyl 12-cyclohexyl-8-cyclohexylimino-1-phenyl-12-azatricyclo[7.2.1.02,7]dodeca-2,4,6,10-tetraene-11-carboxylate
| Molecular Formula | C31H36N2O2 |
|---|---|
| Molecular Weight | 468.28 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 468.27768 |
| Heavy Atoms | 35 |
| Complexity | 831.0 |
Chemical Identifiers
| CAS Number | 28443-85-8 |
|---|---|
| SMILES | COC(=O)C1=CC2C(=NC3CCCCC3)C4=CC=CC=C4C1(N2C5CCCCC5)C6=CC=CC=C6 |
| InChIKey | MXAASLFAJATKOX-UHFFFAOYSA-N |
Product Overview
Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate (CAS 28443-85-8), with molecular formula C31H36N2O2 and molecular weight 468.28 g/mol. IUPAC: methyl 12-cyclohexyl-8-cyclohexylimino-1-phenyl-12-azatricyclo[7.2.1.02,7]dodeca-2,4,6,10-tetraene-11-carboxylate.
Chemical Property Profile of Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate
Property Insights of Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate
The XLogP value of 6.7 indicates that Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate 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 Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate?
The CAS number of Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate is 28443-85-8.
What is the molecular formula of Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate?
The molecular formula of Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate is C31H36N2O2.
What is the molecular weight of Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate?
The molecular weight of Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate is 468.28 g/mol.
Where can I buy Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate?
You can request a quote for Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (9E)-10-cyclohexyl-9-(cyclohexylimino)-5-phenyl-8,9-dihydro-5H-5,8-epiminobenzo[7]annulene-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.