N-(4-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-(4-methylphenyl)-5-{[(2-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-methylphenyl)-5-{[(2-{[2-(2-methylpiperidin-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0322 |
| Compound Name: | N-(4-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(Nc2ccc(C)cc2)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7352 |
| logD: | 1.1743 |
| logSw: | -3.2469 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.803 |
| InChI Key: | IXEZWANZNZAMIN-INIZCTEOSA-N |