N-[2-(azepan-1-yl)ethyl]-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F184-0253 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C23 H34 N4 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCCC(C1)C(NCCN1CCCCCC1)=O)(=O)=O)OCC(N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2951 |
| logD: | -0.4876 |
| logSw: | -2.2156 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.721 |
| InChI Key: | SACLHMWPGPGYDI-SFHVURJKSA-N |