N-(3-chlorophenyl)-5-{[2-(4-ethylpiperazin-1-yl)-2-oxoethoxy]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-{[2-(4-ethylpiperazin-1-yl)-2-oxoethoxy]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-{[2-(4-ethylpiperazin-1-yl)-2-oxoethoxy]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0495 |
| Compound Name: | N-(3-chlorophenyl)-5-{[2-(4-ethylpiperazin-1-yl)-2-oxoethoxy]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C18 H22 Cl N5 O3 S |
| Smiles: | CCN1CCN(CC1)C(COCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5658 |
| logD: | 1.2846 |
| logSw: | -2.7466 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.421 |
| InChI Key: | KOKOLEIWYZSTIV-UHFFFAOYSA-N |