N-(3,4-dimethylphenyl)-N'-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]urea
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-N'-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]urea
N-(3,4-dimethylphenyl)-N'-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]urea
Compound characteristics
| Compound ID: | S796-0472 |
| Compound Name: | N-(3,4-dimethylphenyl)-N'-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]urea |
| Molecular Weight: | 450.58 |
| Molecular Formula: | C26 H34 N4 O3 |
| Smiles: | Cc1ccc(cc1C)NC(NCC(N1CCCCCCNC(CC1c1ccccc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6911 |
| logD: | 3.6911 |
| logSw: | -3.7315 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.033 |
| InChI Key: | NTVZGOKMZUBTTK-QHCPKHFHSA-N |