3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene

C25H26O4 — CID 54244396

IUPAC3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene
SMILESCOc1cccc(C2Oc3ccc(C)cc3CC2c2ccc(OC)cc2OC)c1
InChIInChI=1S/C25H26O4/c1-16-8-11-23-18(12-16)14-22(21-10-9-20(27-3)15-24(21)28-4)25(29-23)17-6-5-7-19(13-17)26-2/h5-13,15,22,25H,14H2,1-4H3
InChIKeyQSFKZMAFDKVFNF-UHFFFAOYSA-N
MW390.48 g/mol
LogP5.48
Rot. Bonds5

About 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene

3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene (PubChem CID 54244396) has the molecular formula C25H26O4 and a molecular weight of 390.48 g/mol. Its IUPAC name is 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene
PubChem CID54244396
Molecular FormulaC25H26O4
Molecular Weight390.48 g/mol
Exact Mass390.18
IUPAC Name3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene
SMILESCOc1cccc(C2Oc3ccc(C)cc3CC2c2ccc(OC)cc2OC)c1
InChIInChI=1S/C25H26O4/c1-16-8-11-23-18(12-16)14-22(21-10-9-20(27-3)15-24(21)28-4)25(29-23)17-6-5-7-19(13-17)26-2/h5-13,15,22,25H,14H2,1-4H3
InChIKeyQSFKZMAFDKVFNF-UHFFFAOYSA-N
XLogP5.48
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.48
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,3R)-2-(4-methoxyphenyl)-3-phenyl-3,4-dihydro-2H-chromene
CID 138963774
trans-(1S,2R)-2-(2,4-dimethoxyphenyl)cyclopropan-1-amine
CID 39238725
3-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazine
CID 116837497
7-methoxy-2-(3-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114714356
(5-methoxy-2,3-dihydro-1-benzofuran-2-yl)methanol
CID 23244646
2-bromo-5-methoxy-N-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methyl]aniline
CID 66362326
8-(2,4-dimethoxyphenyl)-3-methoxybicyclo[4.2.0]octa-1(6),2,4-triene
CID 54445831
(2S,3S)-2-(3-hydroxyphenyl)-7-methoxy-3,4-dihydro-2H-chromen-3-ol
CID 141421484
[(2S,3S)-2-(3,4-dimethoxyphenyl)-7-methoxy-3,4-dihydro-2H-chromen-3-yl] acetate
CID 23241616
(2R)-2-(2,3-dimethoxyphenyl)-6-methoxy-2,3-dihydrochromen-4-one
CID 688727
6-methoxy-4-(3-methylphenyl)-3,4-dihydro-1H-naphthalen-2-one
CID 118052302
(2R)-2-(methoxymethyl)-5-methyl-2,3-dihydro-1-benzofuran
CID 58740913

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene?
The IUPAC name of 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene (CID 54244396) is 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene.
What is the SMILES notation for 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene?
The canonical SMILES for 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene is COc1cccc(C2Oc3ccc(C)cc3CC2c2ccc(OC)cc2OC)c1.
What is the InChIKey of 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene?
The InChIKey is QSFKZMAFDKVFNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26O4/c1-16-8-11-23-18(12-16)14-22(21-10-9-20(27-3)15-24(21)28-4)25(29-23)17-6-5-7-19(13-17)26-2/h5-13,15,22,25H,14H2,1-4H3.
What are the key properties of 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene?
3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene has a molecular weight of 390.48 g/mol, XLogP of 5.48, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethoxyphenyl)-2-(3-methoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 54244396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).