5-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0619 |
| Compound Name: | 5-(3-{[3-(4-benzylpiperazin-1-yl)propyl]amino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C26 H32 N6 O2 S |
| Smiles: | C(CNC(CCc1nnc(C(Nc2ccccc2)=O)s1)=O)CN1CCN(CC1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8739 |
| logD: | 1.0543 |
| logSw: | -2.4831 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.893 |
| InChI Key: | HBBMGYUVRJMIKI-UHFFFAOYSA-N |