2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one
Chemical Structure Depiction of
2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one
2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one
Compound characteristics
| Compound ID: | 8561-07508 |
| Compound Name: | 2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one |
| Molecular Weight: | 329.4 |
| Molecular Formula: | C14 H11 N5 O S2 |
| Smiles: | Cc1nnc(SCC2=CC(n3c4ccccc4nc3N2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.9432 |
| logD: | 1.8162 |
| logSw: | -2.4235 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.997 |
| InChI Key: | CJTNZHCNNBSNSA-UHFFFAOYSA-N |