4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(3-ethoxypropyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(3-ethoxypropyl)-1,4-diazepane-1-carboxamide
4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(3-ethoxypropyl)-1,4-diazepane-1-carboxamide
Compound characteristics
Compound ID: | G797-0386 |
Compound Name: | 4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-N-(3-ethoxypropyl)-1,4-diazepane-1-carboxamide |
Molecular Weight: | 474.4 |
Molecular Formula: | C22 H28 Br N5 O2 |
Smiles: | CCOCCCNC(N1CCCN(CC1)c1c2cccn2c2ccc(cc2n1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 4.4498 |
logD: | 4.2033 |
logSw: | -4.1701 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.179 |
InChI Key: | YLIUERQLFDMIBY-UHFFFAOYSA-N |