6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline

C11H8BrFN2O2 — CID 170284455

IUPAC6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline
SMILESCOc1ncc2c3c(c(Br)c(F)c2n1)COC3
InChIInChI=1S/C11H8BrFN2O2/c1-16-11-14-2-5-6-3-17-4-7(6)8(12)9(13)10(5)15-11/h2H,3-4H2,1H3
InChIKeyJEKHEPWPPODZEN-UHFFFAOYSA-N
MW299.10 g/mol
LogP2.57
Rot. Bonds1

About 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline

6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline (PubChem CID 170284455) has the molecular formula C11H8BrFN2O2 and a molecular weight of 299.10 g/mol. Its IUPAC name is 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline.

Molecular Properties

Compound Name6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline
PubChem CID170284455
Molecular FormulaC11H8BrFN2O2
Molecular Weight299.10 g/mol
Exact Mass297.98
IUPAC Name6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline
SMILESCOc1ncc2c3c(c(Br)c(F)c2n1)COC3
InChIInChI=1S/C11H8BrFN2O2/c1-16-11-14-2-5-6-3-17-4-7(6)8(12)9(13)10(5)15-11/h2H,3-4H2,1H3
InChIKeyJEKHEPWPPODZEN-UHFFFAOYSA-N
XLogP2.57
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.10
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-Bromo-2-fluoro-8-(methoxymethyl)quinazoline
CID 138676809
6-Bromo-3-ethylsulfanyl-5-fluoro-7,9-dihydrofuro[3,4-f]quinazoline
CID 169201864
6-Bromo-1-chloro-5-fluoro-7,9-dihydrofuro[3,4-f]quinazoline
CID 169201889
6-bromo-5-fluoro-3-[[(2R,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-7,9-dihydrofuro[3,4-f]quinazoline
CID 169201941
6-Bromo-3-ethylsulfonyl-5-fluoro-7,9-dihydrofuro[3,4-f]quinazoline
CID 169202043
1-(6-bromo-1-chloro-5-fluoro-7,9-dihydrofuro[3,4-f]quinazolin-3-yl)-N,N-dimethylazetidin-3-amine
CID 172205457
(3S)-1-(6-bromo-1-chloro-5-fluoro-7,9-dihydrofuro[3,4-f]quinazolin-3-yl)-N,N-dimethylpyrrolidin-3-amine
CID 172205599
1-(6-bromo-1-chloro-5-fluoro-7,9-dihydrofuro[3,4-f]quinazolin-3-yl)-N,N,3-trimethylazetidin-3-amine
CID 172205709
1-[1-[(6-bromo-1-chloro-5-fluoro-7,9-dihydrofuro[3,4-f]quinazolin-3-yl)oxymethyl]cyclopropyl]-N,N-dimethylmethanamine
CID 172205736
[1-[(6-Bromo-5-fluoro-7,9-dihydrofuro[3,4-f]quinazolin-3-yl)oxymethyl]-2,2-difluorocyclopropyl]methanol
CID 172215772
6-Bromo-3-[[2,2-difluoro-1-(morpholin-4-ylmethyl)cyclopropyl]methoxy]-5-fluoro-7,9-dihydrofuro[3,4-f]quinazoline
CID 172215773
6-bromo-5-fluoro-N-methyl-3-[3-(methylamino)azetidin-1-yl]-7,9-dihydrofuro[3,4-f]quinazolin-1-amine
CID 172348250

Frequently Asked Questions

What is the IUPAC name of 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline?
The IUPAC name of 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline (CID 170284455) is 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline.
What is the SMILES notation for 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline?
The canonical SMILES for 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline is COc1ncc2c3c(c(Br)c(F)c2n1)COC3.
What is the InChIKey of 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline?
The InChIKey is JEKHEPWPPODZEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrFN2O2/c1-16-11-14-2-5-6-3-17-4-7(6)8(12)9(13)10(5)15-11/h2H,3-4H2,1H3.
What are the key properties of 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline?
6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline has a molecular weight of 299.10 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5-fluoro-3-methoxy-7,9-dihydrofuro[3,4-f]quinazoline is sourced from PubChem (CID 170284455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).