11-(4-butoxyphenyl)-3,3-dimethyl-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(4-butoxyphenyl)-3,3-dimethyl-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(4-butoxyphenyl)-3,3-dimethyl-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | Y010-0235 |
| Compound Name: | 11-(4-butoxyphenyl)-3,3-dimethyl-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 460.62 |
| Molecular Formula: | C29 H36 N2 O3 |
| Smiles: | CCCCOc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)Nc2ccccc2N1C(C(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3997 |
| logD: | 6.1698 |
| logSw: | -5.6473 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.854 |
| InChI Key: | JOKLTBFCQNKXMC-MHZLTWQESA-N |