ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate
TL;DR: ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate (CAS 78816-40-7) is a chemical compound with molecular formula C17H18N2O2 and molecular weight 282.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(6,11-dihydro-5H-benzo[b][1]benzazepin-2-yl)carbamate
Also Known As: ChemDiv1_027163, ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate, BAS 01176559, AJ-292/11894092, ethyl N-(6,11-dihydro-5H-benzo[b][1]benzazepin-2-yl)carbamate
| Molecular Formula | C17H18N2O2 |
|---|---|
| Molecular Weight | 282.14 g/mol |
| LogP | 4.0972 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.13684 |
| Heavy Atoms | 21 |
| Complexity | 667.5897 |
Chemical Identifiers
| CAS Number | 78816-40-7 |
|---|---|
| SMILES | CCOC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2)C=C1 |
Product Overview
ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate (CAS 78816-40-7), with molecular formula C17H18N2O2 and molecular weight 282.14 g/mol. IUPAC: ethyl N-(6,11-dihydro-5H-benzo[b][1]benzazepin-2-yl)carbamate.
Chemical Property Profile of ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate
Property Insights of ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate
The XLogP value of 4.0972 indicates that ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate has 2 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 ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
The CAS number of ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate is 78816-40-7.
What is the molecular formula of ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
The molecular formula of ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate is C17H18N2O2.
What is the molecular weight of ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
The molecular weight of ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate is 282.14 g/mol.
Where can I buy ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
You can request a quote for ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.