6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride
TL;DR: 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride (CAS 97936-38-4) is a chemical compound with molecular formula C12H9N3O and molecular weight 211.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-methyl-1,3,9-triazatricyclo[8.4.0.02,7]tetradeca-2(7),3,5,9,11,13-hexaen-8-one
Also Known As: 9-methyldipyrido[[?],[?]]pyrimidin-5-one, 9-methyl-5H-dipyrido[1,2-a:3',2'-e]pyrimidin-5-one, 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride
| Molecular Formula | C12H9N3O |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 211.07455 |
| Heavy Atoms | 16 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 97936-38-4 |
|---|---|
| SMILES | CC1=CN2C(=NC(=O)C3=C2N=CC=C3)C=C1 |
| InChIKey | RVXZBJKWJRNCNK-UHFFFAOYSA-N |
Product Overview
6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride (CAS 97936-38-4), with molecular formula C12H9N3O and molecular weight 211.07 g/mol. IUPAC: 13-methyl-1,3,9-triazatricyclo[8.4.0.02,7]tetradeca-2(7),3,5,9,11,13-hexaen-8-one.
Chemical Property Profile of 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride
Property Insights of 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride. With a topological polar surface area (TPSA) of 45.6 Ų, 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride 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 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride?
The CAS number of 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride is 97936-38-4.
What is the molecular formula of 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride?
The molecular formula of 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride is C12H9N3O.
What is the molecular weight of 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride?
The molecular weight of 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride is 211.07 g/mol.
Where can I buy 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride?
You can request a quote for 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-4,4b,9-triaza-phenanthren-10-one monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.