Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino
TL;DR: Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino (CAS 3889-00-7) is a chemical compound with molecular formula C18H23N3O and molecular weight 297.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-2-yl)-piperidin-1-ylmethanone
Also Known As: 6-Methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indolyl piperidino ketone, 1H-Azepino(5,4,3-cd)indole, 3,4,5,6-tetrahydro-6-methyl-2-piperidinocarbonyl-, 6-Methyl-2-piperidinocarbonyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3,cd)indole, KETONE, (6-METHYL-3,4,5,6-TETRAHYDRO-1H-AZEPINO(5,4,3-cd)INDOL-2-YL) PIPERIDINO, (+-)-6-Methyl-2-piperidinocarbonyl-3,4,5,6-tetrahydro-1H-azepino<5,4,3-cd>indol
| Molecular Formula | C18H23N3O |
|---|---|
| Molecular Weight | 297.18 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 48.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.1841 |
| Heavy Atoms | 22 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 3889-00-7 |
|---|---|
| SMILES | CC1C2=C3C(=C(NC3=CC=C2)C(=O)N4CCCCC4)CCN1 |
| InChIKey | WGZWPLZNQCSXCL-UHFFFAOYSA-N |
Product Overview
Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino (CAS 3889-00-7), with molecular formula C18H23N3O and molecular weight 297.18 g/mol. IUPAC: (9-methyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-2-yl)-piperidin-1-ylmethanone.
Chemical Property Profile of Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino
Property Insights of Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino. With a topological polar surface area (TPSA) of 48.1 Ų, Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino has 2 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 Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino?
The CAS number of Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino is 3889-00-7.
What is the molecular formula of Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino?
The molecular formula of Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino is C18H23N3O.
What is the molecular weight of Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino?
The molecular weight of Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino is 297.18 g/mol.
Where can I buy Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino?
You can request a quote for Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino?
Yes, KEHONG BIO provides custom synthesis services for Ketone, (6-methyl-3,4,5,6-tetrahydro-1H-azepino(5,4,3-cd)indol-2-yl) piperidino and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.