N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F854-0664 |
| Compound Name: | N-(3-{[2-(4-methylpiperazin-1-yl)ethyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 416.54 |
| Molecular Formula: | C20 H28 N6 O2 S |
| Smiles: | CCCc1nnc(C(Nc2cccc(c2)C(NCCN2CCN(C)CC2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.7672 |
| logD: | 1.0997 |
| logSw: | -2.5385 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.043 |
| InChI Key: | YBEQFUOSXBXDTH-UHFFFAOYSA-N |