5-(4-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-(4-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0351 |
| Compound Name: | 5-(4-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-oxobutyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 458.63 |
| Molecular Formula: | C23 H34 N6 O2 S |
| Smiles: | CCN1CCN(CCCNC(CCCc2nnc(C(Nc3ccc(C)cc3)=O)s2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.5478 |
| logD: | 0.5996 |
| logSw: | -2.3788 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.89 |
| InChI Key: | NQBPYPOIXDDHFR-UHFFFAOYSA-N |