4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide
Chemical Structure Depiction of
4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide
4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide
Compound characteristics
| Compound ID: | Y042-4275 |
| Compound Name: | 4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide |
| Molecular Weight: | 458.6 |
| Molecular Formula: | C21 H26 N6 O2 S2 |
| Smiles: | CC(C)(C)c1nnc(NC(CCC(N2CCN(CC2)c2c3ccccc3sn2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.7191 |
| logD: | 3.6276 |
| logSw: | -3.9194 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.467 |
| InChI Key: | IYRYSFUBIZUEOA-UHFFFAOYSA-N |