N-benzyl-1-(1-ethyl-1H-pyrazole-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(1-ethyl-1H-pyrazole-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-(1-ethyl-1H-pyrazole-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0834 |
| Compound Name: | N-benzyl-1-(1-ethyl-1H-pyrazole-3-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C23 H31 N5 O3 |
| Smiles: | CCn1ccc(C(N2CCCC(CCNC(CC2)=O)C(NCc2ccccc2)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.0822 |
| logD: | -0.0822 |
| logSw: | -1.6419 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.04 |
| InChI Key: | KZWUIIKVRQWVAF-IBGZPJMESA-N |