10-benzoyl-11-(4-tert-butylphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-benzoyl-11-(4-tert-butylphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-benzoyl-11-(4-tert-butylphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 4780-0096 |
| Compound Name: | 10-benzoyl-11-(4-tert-butylphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 556.71 |
| Molecular Formula: | C37 H36 N2 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)OC)Nc2ccccc2N1C(c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.3437 |
| logD: | 8.3019 |
| logSw: | -5.9001 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.437 |
| InChI Key: | LAPSBVORNIXTLS-UHFFFAOYSA-N |