1-(methoxyacetyl)-4-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(methoxyacetyl)-4-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-1,5-diazacycloundecane-8-carboxamide
1-(methoxyacetyl)-4-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1955 |
| Compound Name: | 1-(methoxyacetyl)-4-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 443.47 |
| Molecular Formula: | C21 H28 F3 N3 O4 |
| Smiles: | COCC(N1CCCC(CCNC(CC1)=O)C(NCc1cccc(c1)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.053 |
| logD: | -0.053 |
| logSw: | -1.7744 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.823 |
| InChI Key: | AMSAQBQENWPHHE-INIZCTEOSA-N |