![1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one structure](/static/products/659/65923-22-0.png)
1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one
TL;DR: 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one (CAS 65923-22-0) is a chemical compound with molecular formula C11H9N3O and molecular weight 199.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-3,10,11-triazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13),11-pentaen-9-one
Also Known As: 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one, 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6-ol, 1-methyl-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one, 6-Methyl-2,6-dihydro-1H-[1,2]diazepino[4,5,6-cd]indol-1-one, 3-methyl-3,10,11-triazatricyclo[6.4.1.0,(1)(3)]trideca-1,4,6,8(13),11-pentaen-9-one
| Molecular Formula | C11H9N3O |
|---|---|
| Molecular Weight | 199.07 g/mol |
| LogP | 1.2556 |
| Topological Polar Surface Area | 46.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.07455 |
| Heavy Atoms | 15 |
| Complexity | 595.144 |
Chemical Identifiers
| CAS Number | 65923-22-0 |
|---|---|
| SMILES | CN1C=C2C=NNC(=O)C3=C2C1=CC=C3 |
Product Overview
1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one (CAS 65923-22-0), with molecular formula C11H9N3O and molecular weight 199.07 g/mol. IUPAC: 3-methyl-3,10,11-triazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13),11-pentaen-9-one.
Chemical Property Profile of 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one
Property Insights of 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one
The XLogP value of 1.2556 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one. With a topological polar surface area (TPSA) of 46.39 Ų, 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one has 1 hydrogen bond donor(s) and 2 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 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one?
The CAS number of 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one is 65923-22-0.
What is the molecular formula of 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one?
The molecular formula of 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one is C11H9N3O.
What is the molecular weight of 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one?
The molecular weight of 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one is 199.07 g/mol.
Where can I buy 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one?
You can request a quote for 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-1H-[1,2]diazepino[4,5,6-cd]indol-6(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.