2-ethyl-11-(3-methoxyphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Chemical Structure Depiction of
2-ethyl-11-(3-methoxyphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
2-ethyl-11-(3-methoxyphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Compound characteristics
| Compound ID: | IB04-0863 |
| Compound Name: | 2-ethyl-11-(3-methoxyphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one |
| Molecular Weight: | 411.46 |
| Molecular Formula: | C24 H21 N5 O2 |
| Smiles: | CCC1=Nc2c(C(N1CC=C)=O)c1c(nc3ccccc3n1)n2c1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.44 |
| logD: | 4.44 |
| logSw: | -5.41 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 80.3 |
| InChI Key: | HHPPHSIJABXGIZ-UHFFFAOYSA-N |