2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide

C18H16N2O2S — CID 734093

IUPAC2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
SMILESCOCC(=O)Nc1nc(-c2ccc(-c3ccccc3)cc2)cs1
InChIInChI=1S/C18H16N2O2S/c1-22-11-17(21)20-18-19-16(12-23-18)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,19,20,21)
InChIKeyYMWITJHFEKSYND-UHFFFAOYSA-N
MW324.41 g/mol
LogP4.06
Rot. Bonds5

About 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide

2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 734093) has the molecular formula C18H16N2O2S and a molecular weight of 324.41 g/mol. Its IUPAC name is 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
PubChem CID734093
Molecular FormulaC18H16N2O2S
Molecular Weight324.41 g/mol
Exact Mass324.09
IUPAC Name2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide
SMILESCOCC(=O)Nc1nc(-c2ccc(-c3ccccc3)cc2)cs1
InChIInChI=1S/C18H16N2O2S/c1-22-11-17(21)20-18-19-16(12-23-18)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,19,20,21)
InChIKeyYMWITJHFEKSYND-UHFFFAOYSA-N
XLogP4.06
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.41
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide (CID 734093) is 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide is COCC(=O)Nc1nc(-c2ccc(-c3ccccc3)cc2)cs1.
What is the InChIKey of 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is YMWITJHFEKSYND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2S/c1-22-11-17(21)20-18-19-16(12-23-18)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,19,20,21).
What are the key properties of 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide?
2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 324.41 g/mol, XLogP of 4.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 734093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).