8-(cyclopropanecarbonyl)-1-(6-methylpyridine-3-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
8-(cyclopropanecarbonyl)-1-(6-methylpyridine-3-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
8-(cyclopropanecarbonyl)-1-(6-methylpyridine-3-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S791-0341 |
| Compound Name: | 8-(cyclopropanecarbonyl)-1-(6-methylpyridine-3-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 434.54 |
| Molecular Formula: | C25 H30 N4 O3 |
| Smiles: | Cc1ccc(cn1)C(N1CCCN(C(CC(NCC1)=O)c1ccccc1)C(C1CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3942 |
| logD: | 1.3939 |
| logSw: | -1.7892 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.587 |
| InChI Key: | SFYKBFCINRHQAD-QFIPXVFZSA-N |