methyl N-[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-1,4-diazepane-1-carbonyl]glycinate
Chemical Structure Depiction of
methyl N-[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-1,4-diazepane-1-carbonyl]glycinate
methyl N-[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-1,4-diazepane-1-carbonyl]glycinate
Compound characteristics
| Compound ID: | G797-0416 |
| Compound Name: | methyl N-[4-(7-bromopyrrolo[1,2-a]quinoxalin-4-yl)-1,4-diazepane-1-carbonyl]glycinate |
| Molecular Weight: | 460.33 |
| Molecular Formula: | C20 H22 Br N5 O3 |
| Smiles: | COC(CNC(N1CCCN(CC1)c1c2cccn2c2ccc(cc2n1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2682 |
| logD: | 3.0217 |
| logSw: | -3.3994 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.939 |
| InChI Key: | XXZSDVBFZSSSQA-UHFFFAOYSA-N |