N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide

C15H13N5OS2 — CID 7207402

IUPACN-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide
SMILESCc1csc(NC(=O)CSc2ccc(-c3ccccn3)nn2)n1
InChIInChI=1S/C15H13N5OS2/c1-10-8-23-15(17-10)18-13(21)9-22-14-6-5-12(19-20-14)11-4-2-3-7-16-11/h2-8H,9H2,1H3,(H,17,18,21)
InChIKeyYSEXDYGEUAAJFI-UHFFFAOYSA-N
MW343.44 g/mol
LogP3.03
Rot. Bonds5

About N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide

N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide (PubChem CID 7207402) has the molecular formula C15H13N5OS2 and a molecular weight of 343.44 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide
PubChem CID7207402
Molecular FormulaC15H13N5OS2
Molecular Weight343.44 g/mol
Exact Mass343.06
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide
SMILESCc1csc(NC(=O)CSc2ccc(-c3ccccn3)nn2)n1
InChIInChI=1S/C15H13N5OS2/c1-10-8-23-15(17-10)18-13(21)9-22-14-6-5-12(19-20-14)11-4-2-3-7-16-11/h2-8H,9H2,1H3,(H,17,18,21)
InChIKeyYSEXDYGEUAAJFI-UHFFFAOYSA-N
XLogP3.03
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.44
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(2-((6-methylpyridin-2-yl)amino)thiazol-4-yl)-N-(5-methylthiazol-2-yl)acetamide
CID 49677967
N-(5-pyridin-3-yl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 46872297
N-(4-methylpyridin-2-yl)-4-(pyridin-2-yl)thiazol-2-amine
CID 704452
2-Amino-5-thio-substituted thiazole 61
CID 5329697
1-Phenyl-3-(4-pyridin-2-yl-thiazol-2-yl)-urea
CID 10590030
3-methylsulfanyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)propanamide
CID 2594420
5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 4782304
1-(2,4-Difluorophenyl)-3-[4-(2-pyridinyl)-2-thiazolyl]urea
CID 4799115
2-(6-pyridin-2-ylpyridazin-3-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide
CID 7207400
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(6-pyridin-3-ylpyridazin-3-yl)sulfanylacetamide
CID 7207414
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-(6-pyridin-3-ylpyridazin-3-yl)sulfanylacetamide
CID 7207416
N-[4'-methyl-2-(2-pyridinylamino)-4,5'-bi-1,3-thiazol-2'-yl]propanamide
CID 755435

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide (CID 7207402) is N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide is Cc1csc(NC(=O)CSc2ccc(-c3ccccn3)nn2)n1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide?
The InChIKey is YSEXDYGEUAAJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5OS2/c1-10-8-23-15(17-10)18-13(21)9-22-14-6-5-12(19-20-14)11-4-2-3-7-16-11/h2-8H,9H2,1H3,(H,17,18,21).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide?
N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide has a molecular weight of 343.44 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetamide is sourced from PubChem (CID 7207402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).