5-(3-{4-[(4-ethylpiperazin-1-yl)methyl]anilino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(3-{4-[(4-ethylpiperazin-1-yl)methyl]anilino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-(3-{4-[(4-ethylpiperazin-1-yl)methyl]anilino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0668 |
| Compound Name: | 5-(3-{4-[(4-ethylpiperazin-1-yl)methyl]anilino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 478.62 |
| Molecular Formula: | C25 H30 N6 O2 S |
| Smiles: | CCN1CCN(CC1)Cc1ccc(cc1)NC(CCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3254 |
| logD: | 1.3937 |
| logSw: | -2.7965 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.476 |
| InChI Key: | QWLISLCWKRKBFF-UHFFFAOYSA-N |