5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one
TL;DR: 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one (CAS 3964-74-7) is a chemical compound with molecular formula C14H11NO and molecular weight 209.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one
Also Known As: 5,6-dihydro-11h-benzo[5,6]cyclohepta[1,2-c]pyridin-11-one, 11H-Benzo(5,6)cyclohepta(1,2-c)pyridin-11-one, 5,6-dihydro-, 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyrid-11-one, 5H-benzo[5,6]cyclohepta[1,2-c]pyridin-11(6H)-one, 5,6-dihydrobenzo[1,2]cyclohepta[3,4-a]pyridin-11-one
| Molecular Formula | C14H11NO |
|---|---|
| Molecular Weight | 209.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.08406 |
| Heavy Atoms | 16 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 3964-74-7 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C(=O)C3=C1C=CN=C3 |
| InChIKey | PSHZPPBCBVTVAC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one (CAS 3964-74-7), with molecular formula C14H11NO and molecular weight 209.08 g/mol. IUPAC: 5-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one.
Chemical Property Profile of 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one
Property Insights of 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one. With a topological polar surface area (TPSA) of 30.0 Ų, 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one has 0 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 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one?
The CAS number of 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one is 3964-74-7.
What is the molecular formula of 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one?
The molecular formula of 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one is C14H11NO.
What is the molecular weight of 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one?
The molecular weight of 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one is 209.08 g/mol.
Where can I buy 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one?
You can request a quote for 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dihydro-11H-benzo(5,6)cyclohepta(1,2-c)pyridin-11-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.