N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide

C20H20N2O4S — CID 2531414

IUPACN-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(-c2csc(NC(=O)Cc3ccccc3OC)n2)c1
InChIInChI=1S/C20H20N2O4S/c1-24-14-8-9-18(26-3)15(11-14)16-12-27-20(21-16)22-19(23)10-13-6-4-5-7-17(13)25-2/h4-9,11-12H,10H2,1-3H3,(H,21,22,23)
InChIKeyUJVPTQPWIXKLRQ-UHFFFAOYSA-N
MW384.46 g/mol
LogP4.02
Rot. Bonds7

About N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide

N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide (PubChem CID 2531414) has the molecular formula C20H20N2O4S and a molecular weight of 384.46 g/mol. Its IUPAC name is N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide
PubChem CID2531414
Molecular FormulaC20H20N2O4S
Molecular Weight384.46 g/mol
Exact Mass384.11
IUPAC NameN-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(-c2csc(NC(=O)Cc3ccccc3OC)n2)c1
InChIInChI=1S/C20H20N2O4S/c1-24-14-8-9-18(26-3)15(11-14)16-12-27-20(21-16)22-19(23)10-13-6-4-5-7-17(13)25-2/h4-9,11-12H,10H2,1-3H3,(H,21,22,23)
InChIKeyUJVPTQPWIXKLRQ-UHFFFAOYSA-N
XLogP4.02
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.46
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide?
The IUPAC name of N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide (CID 2531414) is N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide is COc1ccc(OC)c(-c2csc(NC(=O)Cc3ccccc3OC)n2)c1.
What is the InChIKey of N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide?
The InChIKey is UJVPTQPWIXKLRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4S/c1-24-14-8-9-18(26-3)15(11-14)16-12-27-20(21-16)22-19(23)10-13-6-4-5-7-17(13)25-2/h4-9,11-12H,10H2,1-3H3,(H,21,22,23).
What are the key properties of N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide?
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide has a molecular weight of 384.46 g/mol, XLogP of 4.02, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 2531414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).