N-(3,5-dimethoxyphenyl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
N-(3,5-dimethoxyphenyl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Compound characteristics
| Compound ID: | E557-0311 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide |
| Molecular Weight: | 475.52 |
| Molecular Formula: | C22 H25 N3 O7 S |
| Smiles: | COc1cc(cc(c1)OC)NC(CN1C(COc2ccc(cc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3832 |
| logD: | 2.3829 |
| logSw: | -3.021 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.382 |
| InChI Key: | OJKQXCBCNGBUCL-UHFFFAOYSA-N |