N-(3-chlorophenyl)-5-(3-{[(4-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-(3-{[(4-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-(3-{[(4-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-1617 |
| Compound Name: | N-(3-chlorophenyl)-5-(3-{[(4-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C21 H21 Cl N4 O3 S |
| Smiles: | CCOc1ccc(CNC(CCc2nnc(C(Nc3cccc(c3)[Cl])=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7399 |
| logD: | 3.7366 |
| logSw: | -4.1275 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.652 |
| InChI Key: | HRKOXBVZRXVJAA-UHFFFAOYSA-N |