N-(2,2-diethoxyethyl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Chemical Structure Depiction of
N-(2,2-diethoxyethyl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
N-(2,2-diethoxyethyl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Compound characteristics
| Compound ID: | C534-0397 |
| Compound Name: | N-(2,2-diethoxyethyl)-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C20 H29 N3 O7 S |
| Smiles: | CCOC(CNC(CN1C(COc2ccc(cc12)S(N1CCCC1)(=O)=O)=O)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 0.5943 |
| logD: | 0.5943 |
| logSw: | -2.5878 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.542 |
| InChI Key: | FHFXMQWPEBPUDK-UHFFFAOYSA-N |