4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]butanamide
Chemical Structure Depiction of
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]butanamide
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]butanamide
Compound characteristics
Compound ID: | E228-3075 |
Compound Name: | 4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]butanamide |
Molecular Weight: | 498.42 |
Molecular Formula: | C24 H28 Br N5 O2 |
Smiles: | CCn1c(C)c(CCNC(CCCN2C(c3cccn3c3ccc(cc23)[Br])=O)=O)c(C)n1 |
Stereo: | ACHIRAL |
logP: | 2.6462 |
logD: | 2.6455 |
logSw: | -2.9727 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.535 |
InChI Key: | XSQCRVHTEJMIDN-UHFFFAOYSA-N |