N-(naphthalen-1-yl)-2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(naphthalen-1-yl)-2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
N-(naphthalen-1-yl)-2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G432-0049 |
| Compound Name: | N-(naphthalen-1-yl)-2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C21 H20 N4 O2 S2 |
| Smiles: | CC(C)C1=NN2C(=NC(CSCC(Nc3cccc4ccccc34)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.9662 |
| logD: | 3.9622 |
| logSw: | -4.0617 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.451 |
| InChI Key: | VKNMRPFQIRPXIF-UHFFFAOYSA-N |