1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one
TL;DR: 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one (CAS 7403-93-2) is a chemical compound with molecular formula C13H15NO and molecular weight 201.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,4a,5,10b-hexahydro-1H-phenanthridin-6-one
Also Known As: 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one, J2.018.396I, 2,3,4,4a,5,10b-hexahydro-1H-phenanthridin-6-one, 1,2,3,4,4a,5,6,10b-octahydrophenanthridin-6-one, 1,2,3,4,4a,5,6,10b-Octahydrophenanthridine-6-one
| Molecular Formula | C13H15NO |
|---|---|
| Molecular Weight | 201.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.11537 |
| Heavy Atoms | 15 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 7403-93-2 |
|---|---|
| SMILES | C1CCC2C(C1)C3=CC=CC=C3C(=O)N2 |
| InChIKey | CQQBPJQEIHYWQX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one (CAS 7403-93-2), with molecular formula C13H15NO and molecular weight 201.12 g/mol. IUPAC: 2,3,4,4a,5,10b-hexahydro-1H-phenanthridin-6-one.
Chemical Property Profile of 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one
Property Insights of 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one. With a topological polar surface area (TPSA) of 29.1 Ų, 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one 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 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one?
The CAS number of 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one is 7403-93-2.
What is the molecular formula of 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one?
The molecular formula of 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one is C13H15NO.
What is the molecular weight of 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one?
The molecular weight of 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one is 201.12 g/mol.
Where can I buy 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one?
You can request a quote for 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4,4a,5-hexahydrophenanthridin-6(10bH)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.