11-[2-(cyclohex-1-en-1-yl)ethyl]-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Chemical Structure Depiction of
11-[2-(cyclohex-1-en-1-yl)ethyl]-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
11-[2-(cyclohex-1-en-1-yl)ethyl]-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Compound characteristics
| Compound ID: | IB09-5044 |
| Compound Name: | 11-[2-(cyclohex-1-en-1-yl)ethyl]-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C27 H33 N5 O |
| Smiles: | CCCCCCCN1C=Nc2c(C1=O)c1c(nc3ccccc3n1)n2CCC1CCCCC=1 |
| Stereo: | ACHIRAL |
| logP: | 6.49 |
| logD: | 6.49 |
| logSw: | -6.36 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 78.57 |
| InChI Key: | RRZKAHDGSFROPK-UHFFFAOYSA-N |