N-(3,4-dimethylphenyl)-N'-[(2S)-1-oxo-1-(5-oxo-1-oxa-4,8-diazacycloundecan-8-yl)-3-phenylpropan-2-yl]urea
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-N'-[(2S)-1-oxo-1-(5-oxo-1-oxa-4,8-diazacycloundecan-8-yl)-3-phenylpropan-2-yl]urea
N-(3,4-dimethylphenyl)-N'-[(2S)-1-oxo-1-(5-oxo-1-oxa-4,8-diazacycloundecan-8-yl)-3-phenylpropan-2-yl]urea
Compound characteristics
| Compound ID: | S789-0496 |
| Compound Name: | N-(3,4-dimethylphenyl)-N'-[(2S)-1-oxo-1-(5-oxo-1-oxa-4,8-diazacycloundecan-8-yl)-3-phenylpropan-2-yl]urea |
| Molecular Weight: | 466.58 |
| Molecular Formula: | C26 H34 N4 O4 |
| Smiles: | Cc1ccc(cc1C)NC(N[C@@H](Cc1ccccc1)C(N1CCCOCCNC(CC1)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.484 |
| logD: | 2.484 |
| logSw: | -2.97 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.405 |
| InChI Key: | OTNKARUQTLQBRF-QHCPKHFHSA-N |