Compound ID | 3643

Update compound information

Oxopyrido[1,2-alpha]pyrimidine

Synonym(s): Oxopyrido[1,2-α]pyrimidine  |  Compound 1.12

Class: Small molecule antibacterial agent

Agent Type: Synthetic; Small molecule; Direct acting;
Spectrum of activity: Gram-negative
Mechanism of action: DNA synthesis inhibitor. DNA gyrase and topoisomerase IV (bacterial type IIA topoisomerases inhibitor) inhibitor
Target Pathogen: Active against Escherichia coli and Klebsiella pneumoniae
Description: Synthetic compound with oxopyrido[1,2-a]pyrimidine scaffold
Institute where first reported: Hoffmann-La Roche
Year first mentioned: 2021
Development status: Experimental
Chemical structure(s):
Click here for structure editor
Molecular weight:
Iso. SMILES: CNc1c(F)c(F)cc2c1[nH]c3ncc(C4=CN5C(=NC=C(C(=O)O)C5=O)C=C4)c(N(C)C)c23
InChI Key: AXDOYEANBSWLPT-UHFFFAOYSA-N
Can. SMILES: CNC1=C(C(=CC2=C1NC3=C2C(=C(C=N3)C4=CN5C(=NC=C(C5=O)C(=O)O)C=C4)N(C)C)F)F
InChI: InChI=1S/C23H18F2N6O3/c1-26-19-17(25)14(24)6-11-16-20(30(2)3)12(7-28-21(16)29-18(11)19)10-4-5-15-27-8-13(23(33)34)22(32)31(15)9-10/h4-9,26H,1-3H3,(H,28,29)(H,33,34)
External links:
Structure link: https://pubchem.ncbi.nlm.nih.gov/compound/153616452
Citation: https://pubs.acs.org/doi/10.1021/acsmedchemlett.1c00077
Patent: WO2020/127624 A1

AntibioticDB is supported by GARDP.

If you have feedback, experience problems, or are interested in a collaboration, please contact us. | Terms and conditions

The content of this site is intended for educational and scientific research purposes only and not as a source of medical advice or consultation.