1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol

C23H19NOS — CID 10066921

IUPAC1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol
SMILESOC(Cc1cc(-c2ccccc2)sn1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H19NOS/c25-23(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-21-16-22(26-24-21)18-10-4-1-5-11-18/h1-16,25H,17H2
InChIKeyDALQWUYCQOYFMM-UHFFFAOYSA-N
MW357.48 g/mol
LogP5.29
Rot. Bonds5

About 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol

1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol (PubChem CID 10066921) has the molecular formula C23H19NOS and a molecular weight of 357.48 g/mol. Its IUPAC name is 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol.

Molecular Properties

Compound Name1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol
PubChem CID10066921
Molecular FormulaC23H19NOS
Molecular Weight357.48 g/mol
Exact Mass357.12
IUPAC Name1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol
SMILESOC(Cc1cc(-c2ccccc2)sn1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H19NOS/c25-23(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-21-16-22(26-24-21)18-10-4-1-5-11-18/h1-16,25H,17H2
InChIKeyDALQWUYCQOYFMM-UHFFFAOYSA-N
XLogP5.29
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.48
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094110
(2,4-Difluorophenyl)-phenyl-(1,2-thiazol-5-yl)methanol
CID 20253738
2-(3-(4-Fluorophenyl)isothiazol-5-yl)propan-2-ol
CID 68328241
(3-Methyl-1,2-thiazol-5-yl)-phenylmethanol
CID 91620842
(2-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094109
1-[(5-Phenyl-1,2-thiazol-3-yl)methyl]cyclohexan-1-ol
CID 10016135
1-(5-Phenyl-1,2-thiazol-3-yl)-2-[(5-phenyl-1,2-thiazol-3-yl)methyl]pentan-2-ol
CID 10025156
(E)-4-phenyl-1-(5-phenyl-1,2-thiazol-3-yl)-2-[(5-phenyl-1,2-thiazol-3-yl)methyl]but-3-en-2-ol
CID 10367896
1-[(5-Phenyl-1,2-thiazol-3-yl)methyl]cyclopentan-1-ol
CID 10400357
2-Methyl-1-(5-phenyl-1,2-thiazol-3-yl)propan-2-ol
CID 10421504
1-Phenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol
CID 10446470
2-Methyl-1,3-bis(5-phenyl-1,2-thiazol-3-yl)propan-2-ol
CID 11741257

Frequently Asked Questions

What is the IUPAC name of 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol?
The IUPAC name of 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol (CID 10066921) is 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol.
What is the SMILES notation for 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol?
The canonical SMILES for 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol is OC(Cc1cc(-c2ccccc2)sn1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol?
The InChIKey is DALQWUYCQOYFMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NOS/c25-23(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-21-16-22(26-24-21)18-10-4-1-5-11-18/h1-16,25H,17H2.
What are the key properties of 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol?
1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol has a molecular weight of 357.48 g/mol, XLogP of 5.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diphenyl-2-(5-phenyl-1,2-thiazol-3-yl)ethanol is sourced from PubChem (CID 10066921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).