10-benzoyl-11-(4-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-benzoyl-11-(4-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-benzoyl-11-(4-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | Y500-3499 |
| Compound Name: | 10-benzoyl-11-(4-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 494.63 |
| Molecular Formula: | C32 H34 N2 O3 |
| Smiles: | CCCCOc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)Nc2ccccc2N1C(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8024 |
| logD: | 6.7751 |
| logSw: | -5.7086 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.582 |
| InChI Key: | SQYVYHOXYBDHRJ-PMERELPUSA-N |