5-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1,5-diazacycloundecan-2-one
5-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S796-0153 |
| Compound Name: | 5-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C24 H32 N2 O3 |
| Smiles: | COc1cccc(CN2CCCCCCNC(CC2c2ccccc2)=O)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6616 |
| logD: | 2.7172 |
| logSw: | -3.7124 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.261 |
| InChI Key: | QRJPJKTZLXAORZ-NRFANRHFSA-N |