R(+)-2-(heptan-3-yl)quinazolin-4(3H)-one
AlkaPlorer ID: AK015654
Synonym: 'R(+)-2-(heptan-3-yl)quinazolin-4(3H)-one'
IUPAC Name: 2-[(3R)-heptan-3-yl]-3H-quinazolin-4-one
Structure
SMILES: CCCC[C@@H](CC)C1=NC2=C(C=CC=C2)C(=O)N1
InChI: InChI=1S/C15H20N2O/c1-3-5-8-11(4-2)14-16-13-10-7-6-9-12(13)15(18)17-14/h6-7,9-11H,3-5,8H2,1-2H3,(H,16,17,18)/t11-/m1/s1
InChIKey: DAQXBHJQHGIETF-LLVKDONJSA-N
Reference
Antifungal quinazolinones from marine-derived Bacillus cereus and their preparation
PubChem CID: 136015291
LOTUS: LTS0207693
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Bacillus cereus | Bacillus | Bacillaceae | Bacillales | Bacilli | Bacillota | None | Bacteria |
Properties Information
Molecule Weight: 244.338
TPSA？: 45.75
MolLogP？: 3.606900000000002
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Candida albicans | Candida albicans | MIC | 2500.0 | nM | 10.1016/j.bmcl.2011.05.002 |