4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]benzamide
4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | Y042-4071 |
| Compound Name: | 4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 392.44 |
| Molecular Formula: | C19 H16 N6 O2 S |
| Smiles: | CC(C)c1nnc(NC(c2ccc(cc2)N2C(c3ccccc3N=N2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9652 |
| logD: | 3.0743 |
| logSw: | -4.1993 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.15 |
| InChI Key: | JPGGINROQGRQEA-UHFFFAOYSA-N |