![9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole structure](/static/products/3317/33177-03-6.webp)
9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole
TL;DR: 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole (CAS 33177-03-6) is a chemical compound with molecular formula C17H15NO and molecular weight 249.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole
Also Known As: 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole, BAS 01062717, 9-methyl-6H,7H-benzo[f]indolo[3,2-d]oxepin, AH-034/33494047, BRD-K26268785-001-01-7
| Molecular Formula | C17H15NO |
|---|---|
| Molecular Weight | 249.12 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 25.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 249.11537 |
| Heavy Atoms | 19 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 33177-03-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C2CCOC4=CC=CC=C43 |
| InChIKey | XJRRKEHTZWRKGF-UHFFFAOYSA-N |
Product Overview
9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole (CAS 33177-03-6), with molecular formula C17H15NO and molecular weight 249.12 g/mol. IUPAC: 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole.
Chemical Property Profile of 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole
Property Insights of 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole
The XLogP value of 4.1 indicates that 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.0 Ų, 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole has 1 hydrogen bond donor(s) and 1 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 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole?
The CAS number of 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole is 33177-03-6.
What is the molecular formula of 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole?
The molecular formula of 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole is C17H15NO.
What is the molecular weight of 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole?
The molecular weight of 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole is 249.12 g/mol.
Where can I buy 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole?
You can request a quote for 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 9-methyl-7,12-dihydro-6H-[1]benzoxepino[5,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.