methyl 2-{[(5-methyl-1,2-benzoxazol-3-yl)methyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 2-{[(5-methyl-1,2-benzoxazol-3-yl)methyl]carbamamido}benzoate
methyl 2-{[(5-methyl-1,2-benzoxazol-3-yl)methyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | E569-0046 |
| Compound Name: | methyl 2-{[(5-methyl-1,2-benzoxazol-3-yl)methyl]carbamamido}benzoate |
| Molecular Weight: | 339.35 |
| Molecular Formula: | C18 H17 N3 O4 |
| Smiles: | Cc1ccc2c(c1)c(CNC(Nc1ccccc1C(=O)OC)=O)no2 |
| Stereo: | ACHIRAL |
| logP: | 3.2942 |
| logD: | 3.2931 |
| logSw: | -3.673 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.034 |
| InChI Key: | WRHGWCGJQDZEFK-UHFFFAOYSA-N |