N-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
N-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F735-0602 |
| Compound Name: | N-(4-{[3-(4-methylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 430.57 |
| Molecular Formula: | C21 H30 N6 O2 S |
| Smiles: | CCCc1nnc(C(Nc2ccc(cc2)C(NCCCN2CCN(C)CC2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.5896 |
| logD: | 0.4393 |
| logSw: | -2.3742 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.043 |
| InChI Key: | KLIHJNPTLRFJTQ-UHFFFAOYSA-N |