N-(3-chlorophenyl)-5-[(2-{[(2-ethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[(2-{[(2-ethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[(2-{[(2-ethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-1155 |
| Compound Name: | N-(3-chlorophenyl)-5-[(2-{[(2-ethoxyphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 462.98 |
| Molecular Formula: | C20 H19 Cl N4 O3 S2 |
| Smiles: | CCOc1ccccc1CNC(CSc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5174 |
| logD: | 4.5164 |
| logSw: | -4.501 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.605 |
| InChI Key: | VDDTZBVJELMIJC-UHFFFAOYSA-N |