N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Chemical Structure Depiction of
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Compound characteristics
| Compound ID: | Y042-4320 |
| Compound Name: | N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide |
| Molecular Weight: | 372.45 |
| Molecular Formula: | C17 H20 N6 O2 S |
| Smiles: | CC(C)Cc1nnc(NC(CCCN2C(c3ccccc3N=N2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.619 |
| logD: | 2.5333 |
| logSw: | -3.5146 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.101 |
| InChI Key: | ZEPKQAUGIIHUBY-UHFFFAOYSA-N |