N-(3-chlorophenyl)-5-{4-oxo-4-[(2-phenylethyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-{4-oxo-4-[(2-phenylethyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-{4-oxo-4-[(2-phenylethyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0462 |
| Compound Name: | N-(3-chlorophenyl)-5-{4-oxo-4-[(2-phenylethyl)amino]butyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 428.94 |
| Molecular Formula: | C21 H21 Cl N4 O2 S |
| Smiles: | C(CC(NCCc1ccccc1)=O)Cc1nnc(C(Nc2cccc(c2)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.358 |
| logD: | 3.3547 |
| logSw: | -3.7078 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.37 |
| InChI Key: | BEUWGHDFTXZMGR-UHFFFAOYSA-N |