6-(4-benzylpiperazine-1-sulfonyl)-7-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-(4-benzylpiperazine-1-sulfonyl)-7-methyl-2H-1,4-benzoxazin-3(4H)-one
6-(4-benzylpiperazine-1-sulfonyl)-7-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | 8016-9128 |
| Compound Name: | 6-(4-benzylpiperazine-1-sulfonyl)-7-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 401.48 |
| Molecular Formula: | C20 H23 N3 O4 S |
| Smiles: | Cc1cc2c(cc1S(N1CCN(CC1)Cc1ccccc1)(=O)=O)NC(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8309 |
| logD: | 1.8237 |
| logSw: | -2.6983 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.76 |
| InChI Key: | QPGNKYPOWZJWBH-UHFFFAOYSA-N |