3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]propanamide
Chemical Structure Depiction of
3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]propanamide
3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | Y042-4074 |
| Compound Name: | 3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]propanamide |
| Molecular Weight: | 344.39 |
| Molecular Formula: | C15 H16 N6 O2 S |
| Smiles: | CC(C)c1nnc(NC(CCN2C(c3ccccc3N=N2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.3985 |
| logD: | 2.303 |
| logSw: | -3.0771 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.605 |
| InChI Key: | SEACUVMOPUTBBJ-UHFFFAOYSA-N |