2-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one
Chemical Structure Depiction of
2-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one
2-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one
Compound characteristics
| Compound ID: | 8561-07509 |
| Compound Name: | 2-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one |
| Molecular Weight: | 364.45 |
| Molecular Formula: | C18 H12 N4 O S2 |
| Smiles: | C(C1=CC(n2c3ccccc3nc2N1)=O)Sc1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.0656 |
| logD: | 3.9453 |
| logSw: | -4.32 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.407 |
| InChI Key: | IBHFLFYEAVVPRL-UHFFFAOYSA-N |