N-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,2-diphenylacetamide
Chemical Structure Depiction of
N-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,2-diphenylacetamide
N-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,2-diphenylacetamide
Compound characteristics
| Compound ID: | G566-0363 |
| Compound Name: | N-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,2-diphenylacetamide |
| Molecular Weight: | 538.65 |
| Molecular Formula: | C29 H22 N4 O3 S2 |
| Smiles: | CC1=CC2=NC(CSc3nc4ccc(cc4s3)NC(C(c3ccccc3)c3ccccc3)=O)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3738 |
| logD: | 5.3732 |
| logSw: | -5.4114 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.332 |
| InChI Key: | VQQVLMHSNCQAKH-UHFFFAOYSA-N |