4,4'-methylenebis(5-ethyl-2,4-dihydro-3H-1,2,4-triazol-3-one)
Chemical Structure Depiction of
4,4'-methylenebis(5-ethyl-2,4-dihydro-3H-1,2,4-triazol-3-one)
4,4'-methylenebis(5-ethyl-2,4-dihydro-3H-1,2,4-triazol-3-one)
Compound characteristics
| Compound ID: | 8016-7683 |
| Compound Name: | 4,4'-methylenebis(5-ethyl-2,4-dihydro-3H-1,2,4-triazol-3-one) |
| Molecular Weight: | 238.25 |
| Molecular Formula: | C9 H14 N6 O2 |
| Smiles: | CCC1=NNC(N1CN1C(CC)=NNC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2235 |
| logD: | 1.1605 |
| logSw: | -1.3612 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.204 |
| InChI Key: | QHUAPXNQFIWSMH-UHFFFAOYSA-N |