4,7-bis(4-methoxyphenyl)-6-hydroxy-5-methoxybenzo[d]thiazole
AlkaPlorer ID: AK057230
Synonym: None
IUPAC Name: 5-methoxy-4,7-bis(4-methoxyphenyl)-1,3-benzothiazol-6-ol
Structure
SMILES: COC1=CC=C(C2=C(OC)C(O)=C(C3=CC=C(OC)C=C3)C3=C2N=CS3)C=C1
InChI: InChI=1S/C22H19NO4S/c1-25-15-8-4-13(5-9-15)17-19-22(28-12-23-19)18(20(24)21(17)27-3)14-6-10-16(26-2)11-7-14/h4-12,24H,1-3H3
InChIKey: RAGZDYFVJQJGMA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Nocardiopsis gilva | Nocardiopsis | Nocardiopsaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 393.46400000000006
TPSA？: 60.81
MolLogP？: 5.361700000000004
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | A549 | IC50 | 5100.0 | nM | 10.1021/acs.jnatprod.9b00963 |
| Homo sapiens | K562 | IC50 | 770.0 | nM | 10.1021/acs.jnatprod.9b00963 |
| Homo sapiens | L02 | IC50 | 17000.0 | nM | 10.1021/acs.jnatprod.9b00963 |
| Homo sapiens | MCF7 | IC50 | 6000.0 | nM | 10.1021/acs.jnatprod.9b00963 |
| None | Unchecked | IC50 | 9400.0 | nM | 10.1021/acs.jnatprod.9b00963 |