![methyl(propyl)[?]one structure](/static/products/1315/131514-90-4.webp)
methyl(propyl)[?]one
TL;DR: methyl(propyl)[?]one (CAS 131514-90-4) is a chemical compound with molecular formula C14H19N3O and molecular weight 245.15282 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11-methyl-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one
Also Known As: methyl(propyl)[?]one, (+-)-6-Propyl-4,5,6,7-tetrahydro-5-methylimidazo(4,5,1-jk)(1,4)benzodiazepin-2(1H)-one, Imidazo(4,5,1-jk)(1,4)benzodiazepin-2(1H)-one, 4,5,6,7-tetrahydro-5-methyl-6-propyl-, (1)-, Imidazo[4,5,1-jk][1,4]benzodiazepin-2(1H)-one,4,5,6,7-tetrahydro-5-methyl-6-propyl-, 11-methyl-10-propyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H19N3O |
| Molecular Weight | 245.15282 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.15282 Da |
| Heavy Atoms | 18 |
| Complexity | 333.0 |
| SMILES | CCCN1CC2=C3C(=CC=C2)NC(=O)N3CC1C |
| InChIKey | RMWFDGMVDKRISB-UHFFFAOYSA-N |
Chemical Property Profile of methyl(propyl)[?]one
Property Insights of methyl(propyl)[?]one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl(propyl)[?]one. With a topological polar surface area (TPSA) of 35.6 Ų, methyl(propyl)[?]one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl(propyl)[?]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
What is the CAS number of methyl(propyl)[?]one?
The CAS number of methyl(propyl)[?]one is 131514-90-4.
What is the molecular formula of methyl(propyl)[?]one?
The molecular formula of methyl(propyl)[?]one is C14H19N3O.
What is the molecular weight of methyl(propyl)[?]one?
The molecular weight of methyl(propyl)[?]one is 245.15282 g/mol.
Where can I buy methyl(propyl)[?]one?
You can request a quote for methyl(propyl)[?]one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl(propyl)[?]one?
Yes, CoreyChem provides custom synthesis services for methyl(propyl)[?]one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.