4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide

C18H18N4O4S — CID 167771551

IUPAC4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide
SMILESCOCCOc1cc(OC)ccc1C(=O)Nc1ncc(-c2cnccn2)s1
InChIInChI=1S/C18H18N4O4S/c1-24-7-8-26-15-9-12(25-2)3-4-13(15)17(23)22-18-21-11-16(27-18)14-10-19-5-6-20-14/h3-6,9-11H,7-8H2,1-2H3,(H,21,22,23)
InChIKeyUDKRDGJCHRHGHJ-UHFFFAOYSA-N
MW386.43 g/mol
LogP2.89
Rot. Bonds8

About 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide

4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide (PubChem CID 167771551) has the molecular formula C18H18N4O4S and a molecular weight of 386.43 g/mol. Its IUPAC name is 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide
PubChem CID167771551
Molecular FormulaC18H18N4O4S
Molecular Weight386.43 g/mol
Exact Mass386.10
IUPAC Name4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide
SMILESCOCCOc1cc(OC)ccc1C(=O)Nc1ncc(-c2cnccn2)s1
InChIInChI=1S/C18H18N4O4S/c1-24-7-8-26-15-9-12(25-2)3-4-13(15)17(23)22-18-21-11-16(27-18)14-10-19-5-6-20-14/h3-6,9-11H,7-8H2,1-2H3,(H,21,22,23)
InChIKeyUDKRDGJCHRHGHJ-UHFFFAOYSA-N
XLogP2.89
TPSA95.46 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide (CID 167771551) is 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide is COCCOc1cc(OC)ccc1C(=O)Nc1ncc(-c2cnccn2)s1.
What is the InChIKey of 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide?
The InChIKey is UDKRDGJCHRHGHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4S/c1-24-7-8-26-15-9-12(25-2)3-4-13(15)17(23)22-18-21-11-16(27-18)14-10-19-5-6-20-14/h3-6,9-11H,7-8H2,1-2H3,(H,21,22,23).
What are the key properties of 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide?
4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide has a molecular weight of 386.43 g/mol, XLogP of 2.89, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(2-methoxyethoxy)-N-(5-pyrazin-2-yl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 167771551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).