156280-91-0
AlkaPlorer ID: AK033023
Synonym: '', 'Phorbazole A'
IUPAC Name: 4-[4-chloro-2-(3,4-dichloro-1H-pyrrol-2-yl)-1,3-oxazol-5-yl]phenol
Structure
SMILES: OC1=CC=C(C2=C(Cl)N=C(C3=C(Cl)C(Cl)=CN3)O2)C=C1
InChI: InChI=1S/C13H7Cl3N2O2/c14-8-5-17-10(9(8)15)13-18-12(16)11(20-13)6-1-3-7(19)4-2-6/h1-5,17,19H
InChIKey: QSFUDEGJGAYZNO-UHFFFAOYSA-N
Reference
PubChem CID: 578031
CAS: 156280-91-0
LOTUS: LTS0057033
COCONUT: CNP0254725
data_source: manually
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Phorbas clathratus | Phorbas | Hymedesmiidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 329.57000000000005
TPSA？: 62.05
MolLogP？: 5.002500000000001
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|