N-(2-methoxy-5-methylphenyl)-N'-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)urea
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-N'-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)urea
N-(2-methoxy-5-methylphenyl)-N'-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)urea
Compound characteristics
| Compound ID: | G566-1100 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-N'-(2-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)urea |
| Molecular Weight: | 450.52 |
| Molecular Formula: | C23 H22 N4 O4 S |
| Smiles: | CC1=CC2=NC(CSc3ccccc3NC(Nc3cc(C)ccc3OC)=O)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0658 |
| logD: | 3.0658 |
| logSw: | -3.3812 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.968 |
| InChI Key: | IITGETICWCFFMD-UHFFFAOYSA-N |