2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one

C24H17BrN2O2 — CID 18887690

IUPAC2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one
SMILESCn1c(=O)c2c(-c3ccc(Br)cc3)c(Nc3ccccc3)oc2c2ccccc21
InChIInChI=1S/C24H17BrN2O2/c1-27-19-10-6-5-9-18(19)22-21(24(27)28)20(15-11-13-16(25)14-12-15)23(29-22)26-17-7-3-2-4-8-17/h2-14,26H,1H3
InChIKeyFSZDPCIDGIUQED-UHFFFAOYSA-N
MW445.32 g/mol
LogP6.46
Rot. Bonds3

About 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one

2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one (PubChem CID 18887690) has the molecular formula C24H17BrN2O2 and a molecular weight of 445.32 g/mol. Its IUPAC name is 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one.

Molecular Properties

Compound Name2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one
PubChem CID18887690
Molecular FormulaC24H17BrN2O2
Molecular Weight445.32 g/mol
Exact Mass444.05
IUPAC Name2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one
SMILESCn1c(=O)c2c(-c3ccc(Br)cc3)c(Nc3ccccc3)oc2c2ccccc21
InChIInChI=1S/C24H17BrN2O2/c1-27-19-10-6-5-9-18(19)22-21(24(27)28)20(15-11-13-16(25)14-12-15)23(29-22)26-17-7-3-2-4-8-17/h2-14,26H,1H3
InChIKeyFSZDPCIDGIUQED-UHFFFAOYSA-N
XLogP6.46
TPSA47.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.32
LogP ≤ 56.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-anilino-5-methyl-3-(4-propan-2-ylphenyl)furo[3,2-c]quinolin-4-one
CID 18887677
2-anilino-3-(4-ethoxyphenyl)-5-methylfuro[3,2-c]quinolin-4-one
CID 18887696
2-anilino-3-(3,4-dichlorophenyl)-5-methylfuro[3,2-c]quinolin-4-one
CID 18887688
3-(4-methoxyphenyl)-5-methyl-2-(2-methylanilino)furo[3,2-c]quinolin-4-one
CID 18887725
2-(benzylamino)-3-(4-chlorophenyl)-5-methylfuro[3,2-c]quinolin-4-one
CID 18887774
3-(4-bromophenyl)-2-(2,4-dimethylanilino)-5-ethylfuro[3,2-c]quinolin-4-one
CID 18887867
3-(3-fluorophenyl)-5-methyl-2-(2-methylanilino)furo[3,2-c]quinolin-4-one
CID 18887708
3-(3,4-dichlorophenyl)-5-methyl-2-(2-methylanilino)furo[3,2-c]quinolin-4-one
CID 18887715
5-methyl-2-(2-methylanilino)-3-(3-nitrophenyl)furo[3,2-c]quinolin-4-one
CID 18887719
3-bromo-1-methyl-4-phenylquinolin-2-one
CID 50999162
5-methyl-2-(2-methylanilino)-3-(3-propan-2-yloxyphenyl)furo[3,2-c]quinolin-4-one
CID 18887724
2-anilino-3-(4-fluorophenyl)furo[3,2-c]chromen-4-one
CID 18887562

Frequently Asked Questions

What is the IUPAC name of 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one?
The IUPAC name of 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one (CID 18887690) is 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one.
What is the SMILES notation for 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one?
The canonical SMILES for 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one is Cn1c(=O)c2c(-c3ccc(Br)cc3)c(Nc3ccccc3)oc2c2ccccc21.
What is the InChIKey of 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one?
The InChIKey is FSZDPCIDGIUQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17BrN2O2/c1-27-19-10-6-5-9-18(19)22-21(24(27)28)20(15-11-13-16(25)14-12-15)23(29-22)26-17-7-3-2-4-8-17/h2-14,26H,1H3.
What are the key properties of 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one?
2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one has a molecular weight of 445.32 g/mol, XLogP of 6.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-3-(4-bromophenyl)-5-methylfuro[3,2-c]quinolin-4-one is sourced from PubChem (CID 18887690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).