N-(3-chlorophenyl)-5-(3-{[(2-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-(3-{[(2-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-(3-{[(2-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-1600 |
| Compound Name: | N-(3-chlorophenyl)-5-(3-{[(2-ethoxyphenyl)methyl]amino}-3-oxopropyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C21 H21 Cl N4 O3 S |
| Smiles: | CCOc1ccccc1CNC(CCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9803 |
| logD: | 3.9771 |
| logSw: | -4.2841 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.739 |
| InChI Key: | IJSUNOIDSXDXRO-UHFFFAOYSA-N |