3,4,5-trimethoxy-N-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
3,4,5-trimethoxy-N-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
3,4,5-trimethoxy-N-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
| Compound ID: | G566-0326 |
| Compound Name: | 3,4,5-trimethoxy-N-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
| Molecular Weight: | 538.6 |
| Molecular Formula: | C25 H22 N4 O6 S2 |
| Smiles: | CC1=CC2=NC(CSc3nc4ccc(cc4s3)NC(c3cc(c(c(c3)OC)OC)OC)=O)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5925 |
| logD: | 3.5925 |
| logSw: | -3.8655 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.581 |
| InChI Key: | QLEVVIVJCQILJY-UHFFFAOYSA-N |