11-(1H-indol-3-yl)-3,3-dimethyl-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(1H-indol-3-yl)-3,3-dimethyl-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(1H-indol-3-yl)-3,3-dimethyl-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | Y500-5492 |
| Compound Name: | 11-(1H-indol-3-yl)-3,3-dimethyl-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C26 H27 N3 O2 |
| Smiles: | CCC(N1C(C2=C(CC(C)(C)CC2=O)Nc2ccccc12)c1c[nH]c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7671 |
| logD: | 4.5373 |
| logSw: | -4.6894 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.78 |
| InChI Key: | PCEKDXLAAVMYJQ-VWLOTQADSA-N |