5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene

C28H24O — CID 53473730

IUPAC5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene
SMILESCOc1ccc(-c2cc(-c3ccccc3)c3c(c2-c2ccccc2)CCC3)cc1
InChIInChI=1S/C28H24O/c1-29-23-17-15-21(16-18-23)27-19-26(20-9-4-2-5-10-20)24-13-8-14-25(24)28(27)22-11-6-3-7-12-22/h2-7,9-12,15-19H,8,13-14H2,1H3
InChIKeyKVZHDXACMXKMPE-UHFFFAOYSA-N
MW376.50 g/mol
LogP7.18
Rot. Bonds4

About 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene

5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene (PubChem CID 53473730) has the molecular formula C28H24O and a molecular weight of 376.50 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene
PubChem CID53473730
Molecular FormulaC28H24O
Molecular Weight376.50 g/mol
Exact Mass376.18
IUPAC Name5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene
SMILESCOc1ccc(-c2cc(-c3ccccc3)c3c(c2-c2ccccc2)CCC3)cc1
InChIInChI=1S/C28H24O/c1-29-23-17-15-21(16-18-23)27-19-26(20-9-4-2-5-10-20)24-13-8-14-25(24)28(27)22-11-6-3-7-12-22/h2-7,9-12,15-19H,8,13-14H2,1H3
InChIKeyKVZHDXACMXKMPE-UHFFFAOYSA-N
XLogP7.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.50
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-methoxyphenyl)-2-phenyl-5,6,7,8-tetrahydroquinoline
CID 13010672
3,4-bis(4-methoxyphenyl)-6-phenylbenzene-1,2-diamine
CID 87111772
1-methoxy-4-(2-phenylcyclopenten-1-yl)benzene
CID 13444266
1-[4-(4-methoxyphenyl)phenyl]-2,4,6-triphenyl-3,5-bis(4-phenylphenyl)benzene
CID 138981847
4-(4-methoxyphenyl)-2-phenyl-7,8-dihydro-6H-chromen-1-ium-5-one
CID 12943621
1-(4-methoxyphenyl)-4-phenyl-5,6,7,8-tetrahydroisochromen-3-one
CID 162138090
4-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 147099645
6,7-dimethoxy-9,10-diphenyl-1,2,3,4-tetrahydroanthracene
CID 177454119
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050
2-(4-methoxyphenyl)-1,4-diphenylbenzene
CID 132547745
9-methoxy-5-phenyl-1,2,3,4-tetrahydrobenzo[h]quinoline
CID 122234830
1-(4-chlorophenyl)-2-(4-methoxyphenyl)-3-phenylbenzene
CID 173189759

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene?
The IUPAC name of 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene (CID 53473730) is 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene.
What is the SMILES notation for 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene?
The canonical SMILES for 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene is COc1ccc(-c2cc(-c3ccccc3)c3c(c2-c2ccccc2)CCC3)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene?
The InChIKey is KVZHDXACMXKMPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24O/c1-29-23-17-15-21(16-18-23)27-19-26(20-9-4-2-5-10-20)24-13-8-14-25(24)28(27)22-11-6-3-7-12-22/h2-7,9-12,15-19H,8,13-14H2,1H3.
What are the key properties of 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene?
5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene has a molecular weight of 376.50 g/mol, XLogP of 7.18, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-4,7-diphenyl-2,3-dihydro-1H-indene is sourced from PubChem (CID 53473730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).