14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol

C37H26O — CID 121391754

IUPAC14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol
SMILESOC1(c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c2ccccc2-c2ccccc2-c2ccccc21
InChIInChI=1S/C37H26O/c38-37(30-24-28(26-13-3-1-4-14-26)23-29(25-30)27-15-5-2-6-16-27)35-21-11-9-19-33(35)31-17-7-8-18-32(31)34-20-10-12-22-36(34)37/h1-25,38H
InChIKeyHADJNUONXZAPFM-UHFFFAOYSA-N
MW486.61 g/mol
LogP8.95
Rot. Bonds3

About 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol

14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol (PubChem CID 121391754) has the molecular formula C37H26O and a molecular weight of 486.61 g/mol. Its IUPAC name is 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol.

Molecular Properties

Compound Name14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol
PubChem CID121391754
Molecular FormulaC37H26O
Molecular Weight486.61 g/mol
Exact Mass486.20
IUPAC Name14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol
SMILESOC1(c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c2ccccc2-c2ccccc2-c2ccccc21
InChIInChI=1S/C37H26O/c38-37(30-24-28(26-13-3-1-4-14-26)23-29(25-30)27-15-5-2-6-16-27)35-21-11-9-19-33(35)31-17-7-8-18-32(31)34-20-10-12-22-36(34)37/h1-25,38H
InChIKeyHADJNUONXZAPFM-UHFFFAOYSA-N
XLogP8.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.61
LogP ≤ 58.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol with MolForge

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Related Compounds

14-phenyltetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol
CID 13358152
9,9-bis[3-(3-phenylphenyl)phenyl]fluorene
CID 140873482
9-(3,4,5-trifluorophenyl)fluoren-9-ol
CID 154343260
3-[9-[3,5-bis(3-phenylphenyl)phenyl]fluoren-9-yl]-5-phenylphenol
CID 175617635
2-[3-[9-[3,5-bis[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]phenyl]fluoren-9-yl]-5-[4,6-bis(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]phenyl]-4,6-bis(3,5-diphenylphenyl)-1,3,5-triazine
CID 88886282
9-[2-(4-chlorophenyl)phenyl]-2,7-bis(3-phenylphenyl)fluoren-9-ol
CID 155407363
9-[3,5-bis(3-phenylphenyl)phenyl]-9-(3-methyl-5-phenylphenyl)fluorene
CID 171757298
2-[4-(3,5-diphenylphenyl)phenyl]-9,9'-spirobi[fluorene]
CID 140831168
1,3,5-triphenylbenzene
CID 158331433
4,9,14,19,24-pentakis-phenylhexacyclo[20.3.1.12,6.17,11.112,16.117,21]triaconta-1(26),2(30),3,5,7(29),8,10,12(28),13,15,17,19,21(27),22,24-pentadecaene
CID 177480216
9,9-bis[3-[3-tert-butyl-5-(3-phenylphenyl)phenyl]phenyl]fluorene
CID 140873472
17,24-bis(2-phenylphenyl)hexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2,4,6,8,10,12,14,16(25),18,20,22-dodecaene-17,24-diol
CID 89216058

Frequently Asked Questions

What is the IUPAC name of 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol?
The IUPAC name of 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol (CID 121391754) is 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol.
What is the SMILES notation for 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol?
The canonical SMILES for 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol is OC1(c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c2ccccc2-c2ccccc2-c2ccccc21.
What is the InChIKey of 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol?
The InChIKey is HADJNUONXZAPFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26O/c38-37(30-24-28(26-13-3-1-4-14-26)23-29(25-30)27-15-5-2-6-16-27)35-21-11-9-19-33(35)31-17-7-8-18-32(31)34-20-10-12-22-36(34)37/h1-25,38H.
What are the key properties of 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol?
14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol has a molecular weight of 486.61 g/mol, XLogP of 8.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 14-(3,5-diphenylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaen-14-ol is sourced from PubChem (CID 121391754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).