2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide

C18H16N2O3S — CID 17405571

IUPAC2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)Cc1nc(-c2ccc(O)cc2O)cs1
InChIInChI=1S/C18H16N2O3S/c1-11-4-2-3-5-14(11)19-17(23)9-18-20-15(10-24-18)13-7-6-12(21)8-16(13)22/h2-8,10,21-22H,9H2,1H3,(H,19,23)
InChIKeyJZMUJJWXFRQQKY-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.71
Rot. Bonds4

About 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide

2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide (PubChem CID 17405571) has the molecular formula C18H16N2O3S and a molecular weight of 340.40 g/mol. Its IUPAC name is 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
PubChem CID17405571
Molecular FormulaC18H16N2O3S
Molecular Weight340.40 g/mol
Exact Mass340.09
IUPAC Name2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)Cc1nc(-c2ccc(O)cc2O)cs1
InChIInChI=1S/C18H16N2O3S/c1-11-4-2-3-5-14(11)19-17(23)9-18-20-15(10-24-18)13-7-6-12(21)8-16(13)22/h2-8,10,21-22H,9H2,1H3,(H,19,23)
InChIKeyJZMUJJWXFRQQKY-UHFFFAOYSA-N
XLogP3.71
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 8963723
2-[4-(2-bromophenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 8963701
[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 2,4-dihydroxybenzoate
CID 7500956
N-(2-methylphenyl)-2-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
CID 8963676
2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 9420940
2-[4-[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 8963602
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 8963664
N-(2-methylphenyl)-2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]acetamide
CID 8963536
2-[4-(7-ethyl-1H-indol-3-yl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 8963597
N-(2-methylphenyl)-2-[4-[3-(2-oxopyrrolidin-1-yl)phenyl]-1,3-thiazol-2-yl]acetamide
CID 9420953
2-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide
CID 2535547
2-[2-(methoxymethyl)-1,3-thiazol-4-yl]-N-(2-methylphenyl)acetamide
CID 110374734

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide (CID 17405571) is 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)Cc1nc(-c2ccc(O)cc2O)cs1.
What is the InChIKey of 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide?
The InChIKey is JZMUJJWXFRQQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3S/c1-11-4-2-3-5-14(11)19-17(23)9-18-20-15(10-24-18)13-7-6-12(21)8-16(13)22/h2-8,10,21-22H,9H2,1H3,(H,19,23).
What are the key properties of 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide?
2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide has a molecular weight of 340.40 g/mol, XLogP of 3.71, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,4-dihydroxyphenyl)-1,3-thiazol-2-yl]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 17405571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).