N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide

C24H20N2O2S — CID 1008314

IUPACN-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide
SMILESO=C(/N=c1\sc(-c2ccccc2)c(-c2ccccc2)n1CCO)c1ccccc1
InChIInChI=1S/C24H20N2O2S/c27-17-16-26-21(18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)29-24(26)25-23(28)20-14-8-3-9-15-20/h1-15,27H,16-17H2/b25-24-
InChIKeyKEUINQITNOYLAM-IZHYLOQSSA-N
MW400.50 g/mol
LogP4.62
Rot. Bonds5

About N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide

N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide (PubChem CID 1008314) has the molecular formula C24H20N2O2S and a molecular weight of 400.50 g/mol. Its IUPAC name is N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide.

Molecular Properties

Compound NameN-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide
PubChem CID1008314
Molecular FormulaC24H20N2O2S
Molecular Weight400.50 g/mol
Exact Mass400.12
IUPAC NameN-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide
SMILESO=C(/N=c1\sc(-c2ccccc2)c(-c2ccccc2)n1CCO)c1ccccc1
InChIInChI=1S/C24H20N2O2S/c27-17-16-26-21(18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)29-24(26)25-23(28)20-14-8-3-9-15-20/h1-15,27H,16-17H2/b25-24-
InChIKeyKEUINQITNOYLAM-IZHYLOQSSA-N
XLogP4.62
TPSA54.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.50
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide
CID 126212032
4-tert-butyl-N-[3-methyl-5-phenyl-4-(4-phenylphenyl)-1,3-thiazol-2-ylidene]benzamide
CID 126201256
N-[3-methyl-5-phenyl-4-(4-phenylphenyl)-1,3-thiazol-2-ylidene]pyridine-3-carboxamide
CID 3448125
N-[4-(3,4-dimethylphenyl)-3-methyl-5-phenyl-1,3-thiazol-2-ylidene]-3-fluorobenzamide
CID 126210567
N-(5-ethyl-3-methyl-4-phenyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide
CID 4995666
N-(3-ethenyl-4-phenyl-1,3-thiazol-2-ylidene)benzamide
CID 118411247
N-[4,5-bis(4-methoxyphenyl)-3-methyl-1,3-thiazol-2-ylidene]-4-fluorobenzamide
CID 126203694
N-[4,5-bis(4-methoxyphenyl)-3-methyl-1,3-thiazol-2-ylidene]-3-chlorobenzamide
CID 126203998
N-(4,5-diphenyl-3-prop-2-enyl-1,3-thiazol-2-ylidene)benzenesulfonamide
CID 72581893
N-(3,4-dimethyl-5-propan-2-yl-1,3-thiazol-2-ylidene)benzamide
CID 56972553
N-[3-(3,3-dimethyl-2-oxobutyl)-1,3-benzothiazol-2-ylidene]benzamide
CID 4525917
N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)benzamide
CID 43984193

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide?
The IUPAC name of N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide (CID 1008314) is N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide.
What is the SMILES notation for N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide?
The canonical SMILES for N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide is O=C(/N=c1\sc(-c2ccccc2)c(-c2ccccc2)n1CCO)c1ccccc1.
What is the InChIKey of N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide?
The InChIKey is KEUINQITNOYLAM-IZHYLOQSSA-N. The full InChI is InChI=1S/C24H20N2O2S/c27-17-16-26-21(18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)29-24(26)25-23(28)20-14-8-3-9-15-20/h1-15,27H,16-17H2/b25-24-.
What are the key properties of N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide?
N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide has a molecular weight of 400.50 g/mol, XLogP of 4.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide is sourced from PubChem (CID 1008314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).