7-[3-(4-ethylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-[3-(4-ethylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-[3-(4-ethylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-0169 |
| Compound Name: | 7-[3-(4-ethylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C21 H30 N4 O5 S |
| Smiles: | CCN1CCN(CC1)C(C1CCCN(C1)S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4018 |
| logD: | -0.0377 |
| logSw: | -2.2233 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.338 |
| InChI Key: | MHHXETJUFFQWMV-INIZCTEOSA-N |