ethyl 4-[(4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)carbamamido]benzoate
Chemical Structure Depiction of
ethyl 4-[(4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)carbamamido]benzoate
ethyl 4-[(4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)carbamamido]benzoate
Compound characteristics
| Compound ID: | G566-1135 |
| Compound Name: | ethyl 4-[(4-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}phenyl)carbamamido]benzoate |
| Molecular Weight: | 478.53 |
| Molecular Formula: | C24 H22 N4 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NC(Nc1ccc(cc1)SCC1=CC(N2C(C=C(C)O2)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2622 |
| logD: | 4.2622 |
| logSw: | -4.1142 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.487 |
| InChI Key: | BBDSILJJBUXVFJ-UHFFFAOYSA-N |