10-acetyl-3-(3,4-dimethoxyphenyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-acetyl-3-(3,4-dimethoxyphenyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-acetyl-3-(3,4-dimethoxyphenyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 5236-0218 |
| Compound Name: | 10-acetyl-3-(3,4-dimethoxyphenyl)-11-(furan-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 458.51 |
| Molecular Formula: | C27 H26 N2 O5 |
| Smiles: | CC(N1C(C2=C(CC(CC2=O)c2ccc(c(c2)OC)OC)Nc2ccccc12)c1ccco1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9142 |
| logD: | 3.4617 |
| logSw: | -4.1112 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.472 |
| InChI Key: | XORHDAIAVIRLJQ-UHFFFAOYSA-N |