10-butanoyl-3,3-dimethyl-11-(2,3,4-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-butanoyl-3,3-dimethyl-11-(2,3,4-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-butanoyl-3,3-dimethyl-11-(2,3,4-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | Y020-2246 |
| Compound Name: | 10-butanoyl-3,3-dimethyl-11-(2,3,4-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C28 H34 N2 O5 |
| Smiles: | CCCC(N1C(C2=C(CC(C)(C)CC2=O)Nc2ccccc12)c1ccc(c(c1OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0892 |
| logD: | 4.8594 |
| logSw: | -4.8722 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.973 |
| InChI Key: | LGLOCJGYXKXHLL-VWLOTQADSA-N |