2,2-dimethyl-N-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]propanamide
Chemical Structure Depiction of
2,2-dimethyl-N-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]propanamide
2,2-dimethyl-N-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]propanamide
Compound characteristics
| Compound ID: | 8018-9529 |
| Compound Name: | 2,2-dimethyl-N-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]propanamide |
| Molecular Weight: | 245.28 |
| Molecular Formula: | C12 H15 N5 O |
| Smiles: | CC(C)(C)C(Nc1nnc(c2ccncc2)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5657 |
| logD: | 0.1181 |
| logSw: | -1.0384 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.949 |
| InChI Key: | VHKQYCBLTLJSHR-UHFFFAOYSA-N |