6-(2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-7-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-7-methyl-2H-1,4-benzoxazin-3(4H)-one
6-(2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-7-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | 8018-5819 |
| Compound Name: | 6-(2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-7-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 360.39 |
| Molecular Formula: | C17 H16 N2 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCOc3ccccc13)(=O)=O)NC(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8748 |
| logD: | 1.8745 |
| logSw: | -2.6688 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.612 |
| InChI Key: | NYEZUPDYPDQCNC-UHFFFAOYSA-N |