Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci
TL;DR: Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci (CAS 52731-29-0) is a chemical compound with molecular formula C27H27NO5 and molecular weight 445.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-cyclohexyl-1-oxo-6-phenyl-2-benzazocine-4,5-dicarboxylate
Also Known As: Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci, dimethyl 2-cyclohexyl-1-oxo-6-phenyl-2-benzazocine-4,5-dicarboxylate, Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazocine-4, 5-dicarboxylate, Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazocine-4,5-dicarboxylate, 2-Benzazocine-4,5-dicarboxylic acid, 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-, dimethyl ester
| Molecular Formula | C27H27NO5 |
|---|---|
| Molecular Weight | 445.19 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.18893 |
| Heavy Atoms | 33 |
| Complexity | 816.0 |
Chemical Identifiers
| CAS Number | 52731-29-0 |
|---|---|
| SMILES | COC(=O)C1=CN(C(=O)C2=CC=CC=C2C(=C1C(=O)OC)C3=CC=CC=C3)C4CCCCC4 |
| InChIKey | NHAHAIIWMNCEJA-UHFFFAOYSA-N |
Product Overview
Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci (CAS 52731-29-0), with molecular formula C27H27NO5 and molecular weight 445.19 g/mol. IUPAC: dimethyl 2-cyclohexyl-1-oxo-6-phenyl-2-benzazocine-4,5-dicarboxylate.
Chemical Property Profile of Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci
Property Insights of Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci
The XLogP value of 4.4 indicates that Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci. Following Lipinski's Rule of Five, Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci 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 Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci?
The CAS number of Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci is 52731-29-0.
What is the molecular formula of Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci?
The molecular formula of Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci is C27H27NO5.
What is the molecular weight of Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci?
The molecular weight of Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci is 445.19 g/mol.
Where can I buy Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci?
You can request a quote for Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-cyclohexyl-1,2-dihydro-1-oxo-6-phenyl-2-benzazoci and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.