3-[2-(cyclohex-1-en-1-yl)ethyl]-11-(2-methylpropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Chemical Structure Depiction of
3-[2-(cyclohex-1-en-1-yl)ethyl]-11-(2-methylpropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
3-[2-(cyclohex-1-en-1-yl)ethyl]-11-(2-methylpropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Compound characteristics
| Compound ID: | IB09-4052 |
| Compound Name: | 3-[2-(cyclohex-1-en-1-yl)ethyl]-11-(2-methylpropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C24 H27 N5 O |
| Smiles: | CC(C)Cn1c2c(C(N(CCC3CCCCC=3)C=N2)=O)c2c1nc1ccccc1n2 |
| Stereo: | ACHIRAL |
| logP: | 5.03 |
| logD: | 5.03 |
| logSw: | -5.91 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 77.88 |
| InChI Key: | ZIFGVKVHKDHWKC-UHFFFAOYSA-N |