5-[(2-methylpiperazin-1-yl)sulfonyl]isoquinoline
AlkaPlorer ID: AK046909
Synonym: None
IUPAC Name: 5-[(2S)-2-methylpiperazin-1-yl]sulfonylisoquinoline
Structure
SMILES: C[C@H]1CNCCN1S(=O)(=O)C1=CC=CC2=C1C=CN=C2
InChI: InChI=1S/C14H17N3O2S/c1-11-9-16-7-8-17(11)20(18,19)14-4-2-3-12-10-15-6-5-13(12)14/h2-6,10-11,16H,7-9H2,1H3/t11-/m0/s1
InChIKey: BDVFVCGFMNCYPV-NSHDSACASA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Lantana camara | Lantana | Verbenaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Micromonospora | Micromonosporaceae | Micromonosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 291.37600000000003
TPSA？: 62.3
MolLogP？: 1.2172000000000005
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3