8-(cyclopropanecarbonyl)-N-(2-methylpropyl)-5-oxo-7-phenyl-1,4,8-triazacycloundecane-1-carboxamide
Chemical Structure Depiction of
8-(cyclopropanecarbonyl)-N-(2-methylpropyl)-5-oxo-7-phenyl-1,4,8-triazacycloundecane-1-carboxamide
8-(cyclopropanecarbonyl)-N-(2-methylpropyl)-5-oxo-7-phenyl-1,4,8-triazacycloundecane-1-carboxamide
Compound characteristics
| Compound ID: | S791-0522 |
| Compound Name: | 8-(cyclopropanecarbonyl)-N-(2-methylpropyl)-5-oxo-7-phenyl-1,4,8-triazacycloundecane-1-carboxamide |
| Molecular Weight: | 414.55 |
| Molecular Formula: | C23 H34 N4 O3 |
| Smiles: | CC(C)CNC(N1CCCN(C(CC(NCC1)=O)c1ccccc1)C(C1CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8175 |
| logD: | 1.8174 |
| logSw: | -2.1299 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.058 |
| InChI Key: | WFYZJVZBMLAIOH-FQEVSTJZSA-N |