ethyl 5-[4-methoxy-3-(6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)phenyl]-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[4-methoxy-3-(6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)phenyl]-1,2-oxazole-3-carboxylate
ethyl 5-[4-methoxy-3-(6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)phenyl]-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | G115-0623 |
| Compound Name: | ethyl 5-[4-methoxy-3-(6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)phenyl]-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C22 H22 N2 O7 S |
| Smiles: | CCOC(c1cc(c2ccc(c(c2)S(N2CCOc3ccc(C)cc23)(=O)=O)OC)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7933 |
| logD: | 3.7933 |
| logSw: | -3.9724 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.261 |
| InChI Key: | QPDCBGBJRIWFDR-UHFFFAOYSA-N |