N-(3-chlorophenyl)-5-[(2-oxo-2-{[(4-propoxyphenyl)methyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[(2-oxo-2-{[(4-propoxyphenyl)methyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[(2-oxo-2-{[(4-propoxyphenyl)methyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-1177 |
| Compound Name: | N-(3-chlorophenyl)-5-[(2-oxo-2-{[(4-propoxyphenyl)methyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 477 |
| Molecular Formula: | C21 H21 Cl N4 O3 S2 |
| Smiles: | CCCOc1ccc(CNC(CSc2nnc(C(Nc3cccc(c3)[Cl])=O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8674 |
| logD: | 4.8664 |
| logSw: | -4.7334 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.812 |
| InChI Key: | CSKXSVMYMVAVCX-UHFFFAOYSA-N |