5-[({2-[(butan-2-yl)amino]-2-oxoethyl}sulfanyl)methyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[({2-[(butan-2-yl)amino]-2-oxoethyl}sulfanyl)methyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[({2-[(butan-2-yl)amino]-2-oxoethyl}sulfanyl)methyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0013 |
| Compound Name: | 5-[({2-[(butan-2-yl)amino]-2-oxoethyl}sulfanyl)methyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 394.51 |
| Molecular Formula: | C17 H22 N4 O3 S2 |
| Smiles: | CCC(C)NC(CSCc1nnc(C(Nc2ccc(cc2)OC)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6819 |
| logD: | 2.6818 |
| logSw: | -3.1611 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.786 |
| InChI Key: | PAFCYUQJBAAWJS-NSHDSACASA-N |