7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one

C24H15ClO3 — CID 25148063

IUPAC7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one
SMILESCc1c2occ(-c3ccccc3)c2cc2c(=O)cc(-c3ccc(Cl)cc3)oc12
InChIInChI=1S/C24H15ClO3/c1-14-23-18(20(13-27-23)15-5-3-2-4-6-15)11-19-21(26)12-22(28-24(14)19)16-7-9-17(25)10-8-16/h2-13H,1H3
InChIKeyBJLCZBBKPHJPIZ-UHFFFAOYSA-N
MW386.83 g/mol
LogP6.84
Rot. Bonds2

About 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one

7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one (PubChem CID 25148063) has the molecular formula C24H15ClO3 and a molecular weight of 386.83 g/mol. Its IUPAC name is 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one.

Molecular Properties

Compound Name7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one
PubChem CID25148063
Molecular FormulaC24H15ClO3
Molecular Weight386.83 g/mol
Exact Mass386.07
IUPAC Name7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one
SMILESCc1c2occ(-c3ccccc3)c2cc2c(=O)cc(-c3ccc(Cl)cc3)oc12
InChIInChI=1S/C24H15ClO3/c1-14-23-18(20(13-27-23)15-5-3-2-4-6-15)11-19-21(26)12-22(28-24(14)19)16-7-9-17(25)10-8-16/h2-13H,1H3
InChIKeyBJLCZBBKPHJPIZ-UHFFFAOYSA-N
XLogP6.84
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.83
LogP ≤ 56.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-[3-(4-chlorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]-3-phenylpropanoic acid
CID 5157015
6,8-dichloro-2-(4-chlorophenyl)chromen-4-one
CID 688877
6-chloro-8-methyl-2-(4-methylphenyl)chromen-4-one
CID 13190880
6,8-dibromo-2-(4-chlorophenyl)cyclohepta[b]pyran-4,9-dione
CID 5018451
2-[[2-[3-(4-chlorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid
CID 3260945
3-cyclopropyl-9-methyl-5-phenylfuro[3,2-g]chromen-7-one
CID 122537743
2-(4-chlorophenyl)-4-oxochromene-8-carboxylic acid;hydrochloride
CID 70487550
(8-methyl-4-oxo-2-phenylchromen-7-yl) benzoate
CID 71602857
ethyl 4-(4-chlorophenyl)-2-oxo-6-phenylpyran-3-carboxylate
CID 138984790
ethyl 5-(4-chlorophenyl)-3-phenylfuran-2-carboxylate
CID 24751968
6-chloro-2-(4-chlorophenyl)chromen-4-one
CID 688871
2-[[2-[3-(4-chlorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid
CID 4835692

Frequently Asked Questions

What is the IUPAC name of 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one?
The IUPAC name of 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one (CID 25148063) is 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one.
What is the SMILES notation for 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one?
The canonical SMILES for 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one is Cc1c2occ(-c3ccccc3)c2cc2c(=O)cc(-c3ccc(Cl)cc3)oc12.
What is the InChIKey of 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one?
The InChIKey is BJLCZBBKPHJPIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15ClO3/c1-14-23-18(20(13-27-23)15-5-3-2-4-6-15)11-19-21(26)12-22(28-24(14)19)16-7-9-17(25)10-8-16/h2-13H,1H3.
What are the key properties of 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one?
7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one has a molecular weight of 386.83 g/mol, XLogP of 6.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-chlorophenyl)-9-methyl-3-phenylfuro[3,2-g]chromen-5-one is sourced from PubChem (CID 25148063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).