5-(4-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-(4-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0748 |
| Compound Name: | 5-(4-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C26 H32 N6 O2 S |
| Smiles: | C(CC(NCCN1CCN(CC1)Cc1ccccc1)=O)Cc1nnc(C(Nc2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.963 |
| logD: | 1.7464 |
| logSw: | -2.5472 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.893 |
| InChI Key: | YBXYLRXPLIBPLH-UHFFFAOYSA-N |