1-benzyl-N-methyl-7-oxo-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]azepane-2-carboxamide
Chemical Structure Depiction of
1-benzyl-N-methyl-7-oxo-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]azepane-2-carboxamide
1-benzyl-N-methyl-7-oxo-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]azepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0659 |
| Compound Name: | 1-benzyl-N-methyl-7-oxo-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]azepane-2-carboxamide |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C23 H32 N4 O2 |
| Smiles: | Cc1c(CCN(C)C(C2CCCCC(N2Cc2ccccc2)=O)=O)c(C)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7828 |
| logD: | 1.7825 |
| logSw: | -1.9796 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.948 |
| InChI Key: | BPGKFBDMRQFRIW-NRFANRHFSA-N |