methyl 2-{[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazine-1-carbonyl]amino}-4-chlorobenzoate
Chemical Structure Depiction of
methyl 2-{[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazine-1-carbonyl]amino}-4-chlorobenzoate
methyl 2-{[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazine-1-carbonyl]amino}-4-chlorobenzoate
Compound characteristics
Compound ID: | G797-0720 |
Compound Name: | methyl 2-{[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)piperazine-1-carbonyl]amino}-4-chlorobenzoate |
Molecular Weight: | 542.82 |
Molecular Formula: | C24 H21 Br Cl N5 O3 |
Smiles: | COC(c1ccc(cc1NC(N1CCN(CC1)c1c2cccn2c2ccc(cc2n1)[Br])=O)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 5.6904 |
logD: | 5.6221 |
logSw: | -5.9278 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.911 |
InChI Key: | QKUHENLARQTDCC-UHFFFAOYSA-N |