1-(2-bromobenzoyl)-7'-methoxy-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]
AlkaPlorer ID: AK372565
Synonym: None
IUPAC Name: (2-bromophenyl)-(7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-yl)methanone
Structure
SMILES: COC1=CC=C2C(=C1)NC1(CCN(C(=O)C3=CC=CC=C3Br)CC1)C1=CC=CN21
InChI: InChI=1S/C23H22BrN3O2/c1-29-16-8-9-20-19(15-16)25-23(21-7-4-12-27(20)21)10-13-26(14-11-23)22(28)17-5-2-3-6-18(17)24/h2-9,12,15,25H,10-11,13-14H2,1H3
InChIKey: DYAKEYAYGSFEFE-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 452.3520000000001
TPSA？: 46.5
MolLogP？: 4.805400000000005
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Sodium channel protein type IX alpha subunit | IC50 | 414.0 | nM | 10.1016/j.bmcl.2014.07.060 |
| Homo sapiens | Sodium channel protein type V alpha subunit | IC50 | 7601.0 | nM | 10.1016/j.bmcl.2014.07.060 |
| Rattus norvegicus | Rattus norvegicus | AUC | nan | None | 10.1016/j.bmcl.2014.07.060 |