[3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol

C26H19FO2 — CID 69314165

IUPAC[3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol
SMILESOCc1cc2ccccc2c2c1OC(c1ccccc1)(c1ccccc1F)C=C2
InChIInChI=1S/C26H19FO2/c27-24-13-7-6-12-23(24)26(20-9-2-1-3-10-20)15-14-22-21-11-5-4-8-18(21)16-19(17-28)25(22)29-26/h1-16,28H,17H2
InChIKeyIITLIHSJLDQEMW-UHFFFAOYSA-N
MW382.43 g/mol
LogP5.82
Rot. Bonds3

About [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol

[3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol (PubChem CID 69314165) has the molecular formula C26H19FO2 and a molecular weight of 382.43 g/mol. Its IUPAC name is [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol.

Molecular Properties

Compound Name[3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol
PubChem CID69314165
Molecular FormulaC26H19FO2
Molecular Weight382.43 g/mol
Exact Mass382.14
IUPAC Name[3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol
SMILESOCc1cc2ccccc2c2c1OC(c1ccccc1)(c1ccccc1F)C=C2
InChIInChI=1S/C26H19FO2/c27-24-13-7-6-12-23(24)26(20-9-2-1-3-10-20)15-14-22-21-11-5-4-8-18(21)16-19(17-28)25(22)29-26/h1-16,28H,17H2
InChIKeyIITLIHSJLDQEMW-UHFFFAOYSA-N
XLogP5.82
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.43
LogP ≤ 55.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-fluorophenyl)-3-(4-methoxyphenyl)benzo[f]chromene
CID 3104875
N-[(3,3-diphenylbenzo[f]chromen-5-yl)methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
CID 11813174
2,2,5-triphenylbenzo[h]chromene
CID 13007765
(3,3-diphenylbenzo[f]chromen-5-yl) trifluoromethanesulfonate
CID 10983702
[5-[3-(2-fluorophenyl)benzo[f]chromen-3-yl]-2-methoxyphenyl]methanamine
CID 174396690
(2,2-diphenylbenzo[h]chromen-6-yl)methanol
CID 132567770
5-methyl-2,2-diphenylbenzo[h]chromene
CID 23371123
[3-(2-fluorophenyl)-3-(4-methoxyphenyl)benzo[f]chromen-8-yl]-phenylmethanone
CID 3448509
3,3-diphenyl-5-[[5,11,17,23-tetratert-butyl-26,27-bis[(3,3-diphenylbenzo[f]chromen-5-yl)methoxy]-28-propoxy-25-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9(27),10,12,15(26),16,18,21,23-dodecaenyl]oxymethyl]benzo[f]chromene
CID 101247818
tert-butyl N-(3,3-diphenylbenzo[f]chromen-5-yl)carbamate
CID 132609095
3-(2-fluorophenyl)-3-(4-methoxyphenyl)-[1]benzofuro[3,2-f]chromene
CID 3124844
2-N,4-N-bis[3,3-bis(4-fluorophenyl)benzo[f]chromen-5-yl]-6-chloro-1,3,5-triazine-2,4-diamine
CID 102411309

Frequently Asked Questions

What is the IUPAC name of [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol?
The IUPAC name of [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol (CID 69314165) is [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol.
What is the SMILES notation for [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol?
The canonical SMILES for [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol is OCc1cc2ccccc2c2c1OC(c1ccccc1)(c1ccccc1F)C=C2.
What is the InChIKey of [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol?
The InChIKey is IITLIHSJLDQEMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19FO2/c27-24-13-7-6-12-23(24)26(20-9-2-1-3-10-20)15-14-22-21-11-5-4-8-18(21)16-19(17-28)25(22)29-26/h1-16,28H,17H2.
What are the key properties of [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol?
[3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol has a molecular weight of 382.43 g/mol, XLogP of 5.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol is sourced from PubChem (CID 69314165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).