N-(2-methylphenyl)-5-{4-oxo-4-[(1-phenylethyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-{4-oxo-4-[(1-phenylethyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-{4-oxo-4-[(1-phenylethyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0853 |
| Compound Name: | N-(2-methylphenyl)-5-{4-oxo-4-[(1-phenylethyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C22 H24 N4 O2 S |
| Smiles: | CC(c1ccccc1)NC(CCCc1nnc(C(Nc2ccccc2C)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.18 |
| logD: | 3.1799 |
| logSw: | -3.4611 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.994 |
| InChI Key: | QMCJKXDDCWMIBL-INIZCTEOSA-N |