![methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate structure](/static/products/7881/78816-72-5.webp)
methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate
TL;DR: methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate (CAS 78816-72-5) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(6,11-dihydro-5H-benzo[b][1]benzazepin-2-yl)carbamate
Also Known As: ChemDiv1_027119, BAS 01176553, AB00075481-01, AJ-292/11893054, methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate
| Molecular Formula | C16H16N2O2 |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.1212 |
| Heavy Atoms | 20 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 78816-72-5 |
|---|---|
| SMILES | COC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2)C=C1 |
| InChIKey | WOEGGBRWIKORFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate (CAS 78816-72-5), with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol. IUPAC: methyl N-(6,11-dihydro-5H-benzo[b][1]benzazepin-2-yl)carbamate.
Chemical Property Profile of methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate
Property Insights of methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate
The XLogP value of 3.3 indicates that methyl 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 50.4 Ų, methyl 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, methyl 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 methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
The CAS number of methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate is 78816-72-5.
What is the molecular formula of methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
The molecular formula of methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate is C16H16N2O2.
What is the molecular weight of methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
The molecular weight of methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate is 268.12 g/mol.
Where can I buy methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
You can request a quote for methyl 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 methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl 10,11-dihydro-5H-dibenzo[b,f]azepin-3-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.