N-(5-chloro-2,4-dimethoxyphenyl)-N'-(4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)urea
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-N'-(4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)urea
N-(5-chloro-2,4-dimethoxyphenyl)-N'-(4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)urea
Compound characteristics
| Compound ID: | G566-1132 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-N'-(4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)urea |
| Molecular Weight: | 500.96 |
| Molecular Formula: | C23 H21 Cl N4 O5 S |
| Smiles: | CC1=CC2=NC(CSc3ccc(cc3)NC(Nc3cc(c(cc3OC)OC)[Cl])=O)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9606 |
| logD: | 3.9594 |
| logSw: | -4.3976 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.296 |
| InChI Key: | VHVYKCHWRGLWCM-UHFFFAOYSA-N |