N-(m-methylbenzylidene)aniline
TL;DR: N-(m-methylbenzylidene)aniline (CAS 38792-88-0) 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-(7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-yl)carbamate
Also Known As: N-(m-methylbenzylidene)aniline, Ethyl N-(10,11-dihydro-5H-benzo(4,5)cyclohepta(1,2-b)pyrid-5-yl)carbamate, 5H-Benzo(4,5)cyclohepta(1,2-b)pyridine-5-carbamic acid, 10,11-dihydro-, ethyl ester, ethyl 10,11-dihydro-5h-benzo[4,5]cyclohepta[1,2-b]pyridin-5-ylcarbamate, 5H-Benzo[4,5]cyclohepta[1,2-b]pyridine-5-carbamicacid, 10,11-dihydro-, ethyl ester (8CI)
| Molecular Formula | C17H18N2O2 |
|---|---|
| Molecular Weight | 282.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.13684 |
| Heavy Atoms | 21 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 38792-88-0 |
|---|---|
| SMILES | CCOC(=O)NC1C2=C(CCC3=CC=CC=C13)N=CC=C2 |
| InChIKey | JHFNPOKNFLVLFL-UHFFFAOYSA-N |
Product Overview
N-(m-methylbenzylidene)aniline (CAS 38792-88-0), with molecular formula C17H18N2O2 and molecular weight 282.14 g/mol. IUPAC: ethyl N-(7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-yl)carbamate.
Chemical Property Profile of N-(m-methylbenzylidene)aniline
Property Insights of N-(m-methylbenzylidene)aniline
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(m-methylbenzylidene)aniline. With a topological polar surface area (TPSA) of 51.2 Ų, N-(m-methylbenzylidene)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(m-methylbenzylidene)aniline has 1 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 N-(m-methylbenzylidene)aniline?
The CAS number of N-(m-methylbenzylidene)aniline is 38792-88-0.
What is the molecular formula of N-(m-methylbenzylidene)aniline?
The molecular formula of N-(m-methylbenzylidene)aniline is C17H18N2O2.
What is the molecular weight of N-(m-methylbenzylidene)aniline?
The molecular weight of N-(m-methylbenzylidene)aniline is 282.14 g/mol.
Where can I buy N-(m-methylbenzylidene)aniline?
You can request a quote for N-(m-methylbenzylidene)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(m-methylbenzylidene)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-(m-methylbenzylidene)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.