N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine

C24H19Cl2NO2 — CID 20998835

IUPACN-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine
SMILESCOc1ccc(-c2c/c(=N\c3ccc(Cl)cc3Cl)c3c(C)cc(C)cc3o2)cc1
InChIInChI=1S/C24H19Cl2NO2/c1-14-10-15(2)24-21(27-20-9-6-17(25)12-19(20)26)13-22(29-23(24)11-14)16-4-7-18(28-3)8-5-16/h4-13H,1-3H3/b27-21+
InChIKeyVWPZTUWSYHRFRB-SZXQPVLSSA-N
MW424.33 g/mol
LogP7.26
Rot. Bonds3

About N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine

N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine (PubChem CID 20998835) has the molecular formula C24H19Cl2NO2 and a molecular weight of 424.33 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine
PubChem CID20998835
Molecular FormulaC24H19Cl2NO2
Molecular Weight424.33 g/mol
Exact Mass423.08
IUPAC NameN-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine
SMILESCOc1ccc(-c2c/c(=N\c3ccc(Cl)cc3Cl)c3c(C)cc(C)cc3o2)cc1
InChIInChI=1S/C24H19Cl2NO2/c1-14-10-15(2)24-21(27-20-9-6-17(25)12-19(20)26)13-22(29-23(24)11-14)16-4-7-18(28-3)8-5-16/h4-13H,1-3H3/b27-21+
InChIKeyVWPZTUWSYHRFRB-SZXQPVLSSA-N
XLogP7.26
TPSA34.73 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.33
LogP ≤ 57.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[(E)-[2-(4-methoxyphenyl)-5,7-dimethylchromen-4-ylidene]amino]-4-methyl-1,3-thiazol-5-yl]ethanone
CID 20998844
2-(3,4-dimethoxyphenyl)-N-(3-methoxyphenyl)-5,7-dimethylchromen-4-imine
CID 7729878
2-(3,4-dimethoxyphenyl)-5,7-dimethyl-N-phenylchromen-4-imine
CID 7729859
(NZ)-N-[6-chloro-2-(4-methoxyphenyl)-7-methylchromen-4-ylidene]hydroxylamine
CID 7730715
(NE)-N-[2-(3,4-dimethoxyphenyl)-5,7-dimethylchromen-4-ylidene]hydroxylamine
CID 6871166
methyl 2-[(E)-[2-(3,4-dimethoxyphenyl)-5,7-dimethylchromen-4-ylidene]amino]-4-methyl-1,3-thiazole-5-carboxylate
CID 20998888
3-chloro-5-(4-methoxyphenyl)-2-methylfuran
CID 14592116
4-[[2-(3,4-dimethoxyphenyl)-5,7-dimethylchromen-4-ylidene]amino]-1,5-dimethyl-2-phenylpyrazol-3-one
CID 20998885
4-[(5,7-dimethyl-2-phenylchromen-4-ylidene)amino]-1,5-dimethyl-2-phenylpyrazol-3-one
CID 20997924
3-(diethylamino)propyl-[2-(4-methoxyphenyl)-5,7-dimethylchromen-4-ylidene]azanium perchlorate
CID 20998830
3-(3-methoxyphenyl)-2-(4-methoxyphenyl)-4,6-dimethyl-1-benzofuran
CID 134310060
(E)-2-(3,4-dimethoxyphenyl)-5,7-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)chromen-4-imine
CID 20998891

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine?
The IUPAC name of N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine (CID 20998835) is N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine is COc1ccc(-c2c/c(=N\c3ccc(Cl)cc3Cl)c3c(C)cc(C)cc3o2)cc1.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine?
The InChIKey is VWPZTUWSYHRFRB-SZXQPVLSSA-N. The full InChI is InChI=1S/C24H19Cl2NO2/c1-14-10-15(2)24-21(27-20-9-6-17(25)12-19(20)26)13-22(29-23(24)11-14)16-4-7-18(28-3)8-5-16/h4-13H,1-3H3/b27-21+.
What are the key properties of N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine?
N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine has a molecular weight of 424.33 g/mol, XLogP of 7.26, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-(4-methoxyphenyl)-5,7-dimethylchromen-4-imine is sourced from PubChem (CID 20998835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).