4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-2-methyl-3,4-dihydro-2H-1,4-benzoxazine
Chemical Structure Depiction of
4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-2-methyl-3,4-dihydro-2H-1,4-benzoxazine
4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-2-methyl-3,4-dihydro-2H-1,4-benzoxazine
Compound characteristics
| Compound ID: | G115-0303 |
| Compound Name: | 4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonyl]-2-methyl-3,4-dihydro-2H-1,4-benzoxazine |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | CC1CN(c2ccccc2O1)S(c1cc(ccc1C)c1c(C)c(C)no1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3994 |
| logD: | 4.3994 |
| logSw: | -4.2995 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.784 |
| InChI Key: | PAWACVIXJBAFDE-CQSZACIVSA-N |