N-(2-methylpropyl)-3,5-dioxo-2-phenyl-4-propyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-(2-methylpropyl)-3,5-dioxo-2-phenyl-4-propyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-(2-methylpropyl)-3,5-dioxo-2-phenyl-4-propyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V001-0971 |
| Compound Name: | N-(2-methylpropyl)-3,5-dioxo-2-phenyl-4-propyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 330.38 |
| Molecular Formula: | C17 H22 N4 O3 |
| Salt: | not_available |
| Smiles: | CCCN1C(C(C(NCC(C)C)=O)=NN(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3564 |
| logD: | 2.3563 |
| logSw: | -2.6337 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.18 |
| InChI Key: | IIRMKQSCZVPWCM-UHFFFAOYSA-N |