N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Chemical Structure Depiction of
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Compound characteristics
| Compound ID: | Y042-4322 |
| Compound Name: | N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide |
| Molecular Weight: | 356.4 |
| Molecular Formula: | C16 H16 N6 O2 S |
| Smiles: | C(CC(Nc1nnc(C2CC2)s1)=O)CN1C(c2ccccc2N=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9526 |
| logD: | 1.8705 |
| logSw: | -2.8381 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.857 |
| InChI Key: | KRKMFJOXFVVLNA-UHFFFAOYSA-N |