6-(azepane-1-carbonyl)-4-methyl-2-(4-methylphenyl)-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
6-(azepane-1-carbonyl)-4-methyl-2-(4-methylphenyl)-1,2,4-triazine-3,5(2H,4H)-dione
6-(azepane-1-carbonyl)-4-methyl-2-(4-methylphenyl)-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | G674-0032 |
| Compound Name: | 6-(azepane-1-carbonyl)-4-methyl-2-(4-methylphenyl)-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C18 H22 N4 O3 |
| Smiles: | Cc1ccc(cc1)N1C(N(C)C(C(C(N2CCCCCC2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6649 |
| logD: | 2.6649 |
| logSw: | -2.8655 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.262 |
| InChI Key: | ZXJNLVNQLUIHFI-UHFFFAOYSA-N |