N-(3-methylphenyl)-2-({[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-methylphenyl)-2-({[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
N-(3-methylphenyl)-2-({[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G432-0096 |
| Compound Name: | N-(3-methylphenyl)-2-({[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 402.54 |
| Molecular Formula: | C19 H22 N4 O2 S2 |
| Smiles: | CC(C)CC1=NN2C(=NC(CSCC(Nc3cccc(C)c3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.1486 |
| logD: | 4.1474 |
| logSw: | -4.2332 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.324 |
| InChI Key: | FVKJZIWPJHFZKO-UHFFFAOYSA-N |