3-(2-acetamido-3,4,6-tri-O-acetyl-2-deoxyhexopyranosyl)-5-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(2-acetamido-3,4,6-tri-O-acetyl-2-deoxyhexopyranosyl)-5-methyl-1,3-benzoxazol-2(3H)-one
3-(2-acetamido-3,4,6-tri-O-acetyl-2-deoxyhexopyranosyl)-5-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | 8019-0374 |
| Compound Name: | 3-(2-acetamido-3,4,6-tri-O-acetyl-2-deoxyhexopyranosyl)-5-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 478.45 |
| Molecular Formula: | C22 H26 N2 O10 |
| Smiles: | CC(NC1C(C(C(COC(C)=O)OC1N1C(=O)Oc2ccc(C)cc12)OC(C)=O)OC(C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3668 |
| logD: | 1.3668 |
| logSw: | -2.1075 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.078 |
| InChI Key: | ADPGYBYHERESMD-UHFFFAOYSA-N |