3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-
TL;DR: 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl- (CAS 117258-21-6) is a chemical compound with molecular formula C9H7Cl2N3O and molecular weight 242.99661 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,4-dichlorophenyl)-4-methyl-1H-1,2,4-triazol-5-one
Also Known As: 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-, 2,4-Dihydro-5-(3,4-dichlorophenyl)-4-methyl-3H-1,2,4-triazol-3-one, 3-(3,4-dichlorophenyl)-4-methyl-1H-1,2,4-triazol-5-one, 4-Methyl-5-(3,4-dichlorophenyl)-2H-1,2,4-triazol-3(4H)-one, 3-(3,4-dichlorophenyl)-4-methyl-4,5-dihydro-1H-1,2,4-triazol-5-one
Technical Specifications
| Molecular Formula | C9H7Cl2N3O |
| Molecular Weight | 242.99661 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 242.99661 Da |
| Heavy Atoms | 15 |
| Complexity | 308.0 |
| SMILES | CN1C(=NNC1=O)C2=CC(=C(C=C2)Cl)Cl |
| InChIKey | RAAQUASDKGHGNR-UHFFFAOYSA-N |
Chemical Property Profile of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-
Property Insights of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-. With a topological polar surface area (TPSA) of 44.7 Ų, 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl- 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 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-?
The CAS number of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl- is 117258-21-6.
What is the molecular formula of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-?
The molecular formula of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl- is C9H7Cl2N3O.
What is the molecular weight of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-?
The molecular weight of 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl- is 242.99661 g/mol.
Where can I buy 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-?
You can request a quote for 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl-?
Yes, CoreyChem provides custom synthesis services for 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(3,4-dichlorophenyl)-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.