4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | E557-0342 |
| Compound Name: | 4-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-6-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 490.62 |
| Molecular Formula: | C24 H34 N4 O5 S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CN1C(COc2ccc(cc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8297 |
| logD: | 1.6673 |
| logSw: | -2.6826 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.631 |
| InChI Key: | MJJHSSIPHSWNQY-UHFFFAOYSA-N |