4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[1-(thiophen-2-yl)butyl]butanamide
Chemical Structure Depiction of
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[1-(thiophen-2-yl)butyl]butanamide
4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[1-(thiophen-2-yl)butyl]butanamide
Compound characteristics
Compound ID: | E228-3072 |
Compound Name: | 4-(7-bromo-4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)-N-[1-(thiophen-2-yl)butyl]butanamide |
Molecular Weight: | 486.43 |
Molecular Formula: | C23 H24 Br N3 O2 S |
Smiles: | CCCC(c1cccs1)NC(CCCN1C(c2cccn2c2ccc(cc12)[Br])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.7778 |
logD: | 4.7778 |
logSw: | -4.4349 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.064 |
InChI Key: | NJIOCVUGFMLFDR-KRWDZBQOSA-N |