2-(1,2-dimethyl-1H-indol-3-yl)-5,7-diphenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Chemical Structure Depiction of
2-(1,2-dimethyl-1H-indol-3-yl)-5,7-diphenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
2-(1,2-dimethyl-1H-indol-3-yl)-5,7-diphenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Compound characteristics
| Compound ID: | D115-0004 |
| Compound Name: | 2-(1,2-dimethyl-1H-indol-3-yl)-5,7-diphenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C30 H29 N3 O |
| Smiles: | Cc1c(C2N3CC4(CN2CC(C3)(C4=O)c2ccccc2)c2ccccc2)c2ccccc2n1C |
| Stereo: | ACHIRAL |
| logP: | 4.7027 |
| logD: | 4.7026 |
| logSw: | -4.5476 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 21.6571 |
| InChI Key: | XSHITEFXVRFALF-UHFFFAOYSA-N |