4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(furan-2-yl)ethyl]butanamide
Chemical Structure Depiction of
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(furan-2-yl)ethyl]butanamide
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(furan-2-yl)ethyl]butanamide
Compound characteristics
Compound ID: | E228-3100 |
Compound Name: | 4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(furan-2-yl)ethyl]butanamide |
Molecular Weight: | 442.31 |
Molecular Formula: | C21 H20 Br N3 O3 |
Smiles: | C(CC(NCCc1ccco1)=O)CN1C(c2cccn2c2ccc(cc12)[Br])=O |
Stereo: | ACHIRAL |
logP: | 3.0369 |
logD: | 3.0369 |
logSw: | -3.3678 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.006 |
InChI Key: | WMFGFRULSZAPJY-UHFFFAOYSA-N |