7-[3-(4-benzylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-[3-(4-benzylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-[3-(4-benzylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F184-0125 |
| Compound Name: | 7-[3-(4-benzylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 511.64 |
| Molecular Formula: | C27 H33 N3 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCCC(C1)C(N1CCC(CC1)Cc1ccccc1)=O)(=O)=O)OCC(N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2098 |
| logD: | 3.2093 |
| logSw: | -3.4633 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.53 |
| InChI Key: | QKLJWWXITQSBCX-QFIPXVFZSA-N |