1,3-dimethyl-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1,3-dimethyl-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]-1H-pyrazole-5-carboxamide
1,3-dimethyl-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | S796-0449 |
| Compound Name: | 1,3-dimethyl-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C23 H31 N5 O3 |
| Smiles: | Cc1cc(C(NCC(N2CCCCCCNC(CC2c2ccccc2)=O)=O)=O)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0584 |
| logD: | 1.0583 |
| logSw: | -1.8867 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.144 |
| InChI Key: | MBOGWAXDZIKNOR-IBGZPJMESA-N |