N-(2-methylphenyl)-5-{4-oxo-4-[(3-phenylpropyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-{4-oxo-4-[(3-phenylpropyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-{4-oxo-4-[(3-phenylpropyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0832 |
| Compound Name: | N-(2-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: | Cc1ccccc1NC(c1nnc(CCCC(NCCCc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.574 |
| logD: | 3.5739 |
| logSw: | -3.818 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.673 |
| InChI Key: | RENBITDIPVTFOQ-UHFFFAOYSA-N |