8-(cyclopropanecarbonyl)-1-(1-methyl-1H-pyrrole-2-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
Chemical Structure Depiction of
8-(cyclopropanecarbonyl)-1-(1-methyl-1H-pyrrole-2-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
8-(cyclopropanecarbonyl)-1-(1-methyl-1H-pyrrole-2-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one
Compound characteristics
| Compound ID: | S791-0381 |
| Compound Name: | 8-(cyclopropanecarbonyl)-1-(1-methyl-1H-pyrrole-2-carbonyl)-7-phenyl-1,4,8-triazacycloundecan-5-one |
| Molecular Weight: | 422.53 |
| Molecular Formula: | C24 H30 N4 O3 |
| Smiles: | Cn1cccc1C(N1CCCN(C(CC(NCC1)=O)c1ccccc1)C(C1CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1083 |
| logD: | 2.1083 |
| logSw: | -2.6853 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.06 |
| InChI Key: | WZOXOKGTBFVIAC-NRFANRHFSA-N |