N-(4-methylphenyl)-5-{4-oxo-4-[(3-phenylpropyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-5-{4-oxo-4-[(3-phenylpropyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-methylphenyl)-5-{4-oxo-4-[(3-phenylpropyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0239 |
| Compound Name: | N-(4-methylphenyl)-5-{4-oxo-4-[(3-phenylpropyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(CCCC(NCCCc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0043 |
| logD: | 4.0043 |
| logSw: | -4.1419 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.37 |
| InChI Key: | KSPXZRJKIYQYQJ-UHFFFAOYSA-N |