4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[(2,3-dimethoxyphenyl)methyl]butanamide
Chemical Structure Depiction of
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[(2,3-dimethoxyphenyl)methyl]butanamide
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[(2,3-dimethoxyphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | E228-3094 |
| Compound Name: | 4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[(2,3-dimethoxyphenyl)methyl]butanamide |
| Molecular Weight: | 498.38 |
| Molecular Formula: | C24 H24 Br N3 O4 |
| Smiles: | COc1cccc(CNC(CCCN2C(c3cccn3c3ccc(cc23)[Br])=O)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.8411 |
| logD: | 3.8411 |
| logSw: | -3.9484 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.763 |
| InChI Key: | RQRWRMCCJIMFMB-UHFFFAOYSA-N |