7-[4-(2-ethylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-[4-(2-ethylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-[4-(2-ethylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-0836 |
| Compound Name: | 7-[4-(2-ethylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C22 H31 N3 O5 S |
| Smiles: | CCC1CCCCN1C(C1CCN(CC1)S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0628 |
| logD: | 2.0623 |
| logSw: | -2.6919 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.514 |
| InChI Key: | VSJCWANTVXRCOZ-KRWDZBQOSA-N |