4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide

C20H15N3OS2 — CID 122162295

IUPAC4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide
SMILESO=C(NCc1nccnc1-c1ccsc1)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C20H15N3OS2/c24-20(15-5-3-14(4-6-15)18-2-1-10-26-18)23-12-17-19(22-9-8-21-17)16-7-11-25-13-16/h1-11,13H,12H2,(H,23,24)
InChIKeyYSDGJTQOUWPEPK-UHFFFAOYSA-N
MW377.49 g/mol
LogP4.86
Rot. Bonds5

About 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide

4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide (PubChem CID 122162295) has the molecular formula C20H15N3OS2 and a molecular weight of 377.49 g/mol. Its IUPAC name is 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide.

Molecular Properties

Compound Name4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide
PubChem CID122162295
Molecular FormulaC20H15N3OS2
Molecular Weight377.49 g/mol
Exact Mass377.07
IUPAC Name4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide
SMILESO=C(NCc1nccnc1-c1ccsc1)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C20H15N3OS2/c24-20(15-5-3-14(4-6-15)18-2-1-10-26-18)23-12-17-19(22-9-8-21-17)16-7-11-25-13-16/h1-11,13H,12H2,(H,23,24)
InChIKeyYSDGJTQOUWPEPK-UHFFFAOYSA-N
XLogP4.86
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-4-thiophen-2-ylbenzamide
CID 119105875
2,6-difluoro-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide
CID 122162296
3,4,5-triethoxy-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide
CID 122276832
6-methoxy-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]pyridine-3-carboxamide
CID 122276864
5-methyl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]pyrazine-2-carboxamide
CID 122276820
2-bromo-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide
CID 122246168
(E)-3-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]prop-2-enamide
CID 122162269
N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 122276862
N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]-2-(trifluoromethyl)benzamide
CID 122162286
N-[(3-pyridin-4-ylpyrazin-2-yl)methyl]benzamide
CID 126854250
N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]-1,3-benzothiazole-2-carboxamide
CID 122162281
1-phenyl-3-[(3-thiophen-3-ylpyrazin-2-yl)methyl]urea
CID 122276965

Frequently Asked Questions

What is the IUPAC name of 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide?
The IUPAC name of 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide (CID 122162295) is 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide.
What is the SMILES notation for 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide?
The canonical SMILES for 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide is O=C(NCc1nccnc1-c1ccsc1)c1ccc(-c2cccs2)cc1.
What is the InChIKey of 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide?
The InChIKey is YSDGJTQOUWPEPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3OS2/c24-20(15-5-3-14(4-6-15)18-2-1-10-26-18)23-12-17-19(22-9-8-21-17)16-7-11-25-13-16/h1-11,13H,12H2,(H,23,24).
What are the key properties of 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide?
4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide has a molecular weight of 377.49 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-thiophen-2-yl-N-[(3-thiophen-3-ylpyrazin-2-yl)methyl]benzamide is sourced from PubChem (CID 122162295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).