N-(2-methylphenyl)-5-{[(2-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-{[(2-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-{[(2-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-1190 |
| Compound Name: | N-(2-methylphenyl)-5-{[(2-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 447.62 |
| Molecular Formula: | C21 H29 N5 O2 S2 |
| Smiles: | CC1CCCCN1CCNC(CSCc1nnc(C(Nc2ccccc2C)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3049 |
| logD: | 0.744 |
| logSw: | -2.6904 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.106 |
| InChI Key: | OOSURDROVNGPBV-INIZCTEOSA-N |