5-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0533 |
| Compound Name: | 5-(3-{[(2-methoxyphenyl)methyl]amino}-3-oxopropyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C20 H20 N4 O3 S |
| Smiles: | COc1ccccc1CNC(CCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.647 |
| logD: | 2.6469 |
| logSw: | -3.2167 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.159 |
| InChI Key: | OUGULYKKQNASSA-UHFFFAOYSA-N |