5-(4-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
5-(4-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0157 |
| Compound Name: | 5-(4-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-oxobutyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 474.62 |
| Molecular Formula: | C23 H34 N6 O3 S |
| Smiles: | CCN1CCN(CCCNC(CCCc2nnc(C(Nc3ccc(cc3)OC)=O)s2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.1068 |
| logD: | 0.1586 |
| logSw: | -2.2005 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.433 |
| InChI Key: | UWGHSZDPOUUYSD-UHFFFAOYSA-N |