2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide

C17H14N2OS2 — CID 54224209

IUPAC2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide
SMILESNC(=O)CSc1nc(-c2ccccc2)c(-c2ccccc2)s1
InChIInChI=1S/C17H14N2OS2/c18-14(20)11-21-17-19-15(12-7-3-1-4-8-12)16(22-17)13-9-5-2-6-10-13/h1-10H,11H2,(H2,18,20)
InChIKeyQESLAWBVTSWOAB-UHFFFAOYSA-N
MW326.45 g/mol
LogP4.05
Rot. Bonds5

About 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide

2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide (PubChem CID 54224209) has the molecular formula C17H14N2OS2 and a molecular weight of 326.45 g/mol. Its IUPAC name is 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide.

Molecular Properties

Compound Name2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide
PubChem CID54224209
Molecular FormulaC17H14N2OS2
Molecular Weight326.45 g/mol
Exact Mass326.05
IUPAC Name2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide
SMILESNC(=O)CSc1nc(-c2ccccc2)c(-c2ccccc2)s1
InChIInChI=1S/C17H14N2OS2/c18-14(20)11-21-17-19-15(12-7-3-1-4-8-12)16(22-17)13-9-5-2-6-10-13/h1-10H,11H2,(H2,18,20)
InChIKeyQESLAWBVTSWOAB-UHFFFAOYSA-N
XLogP4.05
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.45
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetic acid
CID 54440885
2-[[4,5-bis(4-chlorophenyl)-1,3-thiazol-2-yl]sulfanyl]acetamide
CID 21408453
7-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]heptanamide
CID 54374402
1-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]propan-2-one;propane
CID 169104011
4-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]butanoic acid
CID 13491147
2-[[5-(4-aminophenyl)-4-(4-chlorophenyl)-1,3-thiazol-2-yl]sulfanyl]acetic acid
CID 21408730
2-[(2-methyl-7-phenyl-[1,3]thiazolo[4,5-d]pyridazin-4-yl)sulfanyl]acetamide
CID 16858086
N-(2-bromo-4,6-difluorophenyl)-2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide
CID 23771975
2-[[4-(4-chlorophenyl)-5-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]sulfanyl]acetic acid
CID 21408440
2-[(2-methyl-7-phenyl-[1,3]thiazolo[5,4-d]pyrimidin-5-yl)sulfanyl]acetamide
CID 51700690
2-(4,5-diphenyl-1,3-thiazol-2-yl)guanidine
CID 3147443
N-(2-phenacylsulfanyl-4-phenyl-1,3-thiazol-5-yl)benzamide
CID 163347744

Frequently Asked Questions

What is the IUPAC name of 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide?
The IUPAC name of 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide (CID 54224209) is 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide.
What is the SMILES notation for 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide?
The canonical SMILES for 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide is NC(=O)CSc1nc(-c2ccccc2)c(-c2ccccc2)s1.
What is the InChIKey of 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide?
The InChIKey is QESLAWBVTSWOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2OS2/c18-14(20)11-21-17-19-15(12-7-3-1-4-8-12)16(22-17)13-9-5-2-6-10-13/h1-10H,11H2,(H2,18,20).
What are the key properties of 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide?
2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide has a molecular weight of 326.45 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4,5-diphenyl-1,3-thiazol-2-yl)sulfanyl]acetamide is sourced from PubChem (CID 54224209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).