methyl (2E)-3-(6-bromo-1H-indol-3-yl)prop-2-enoate
AlkaPlorer ID: AK439706
Synonym: None
IUPAC Name: methyl (E)-3-(6-bromo-1H-indol-3-yl)prop-2-enoate
Structure
SMILES: COC(=O)/C=C/C1=CNC2=CC(Br)=CC=C12
InChI: InChI=1S/C12H10BrNO2/c1-16-12(15)5-2-8-7-14-11-6-9(13)3-4-10(8)11/h2-7,14H,1H3/b5-2+
InChIKey: KXOFEQMCIBBYME-GORDUTHDSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mycale adhaerens | Mycale | Mycalidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 280.121
TPSA？: 42.09
MolLogP？: 3.116600000000001
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Haemonchus contortus | Haemonchus contortus | LD99 | 50.0 | ug ml-1 | 10.1021/np010337u |