4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole

C15H11N3S3 — CID 35456975

IUPAC4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole
SMILESc1ccn2c(SCc3csc(-c4ccsc4)n3)ncc2c1
InChIInChI=1S/C15H11N3S3/c1-2-5-18-13(3-1)7-16-15(18)21-10-12-9-20-14(17-12)11-4-6-19-8-11/h1-9H,10H2
InChIKeyCJFMMNWFDKHHGY-UHFFFAOYSA-N
MW329.48 g/mol
LogP4.81
Rot. Bonds4

About 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole

4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole (PubChem CID 35456975) has the molecular formula C15H11N3S3 and a molecular weight of 329.48 g/mol. Its IUPAC name is 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole
PubChem CID35456975
Molecular FormulaC15H11N3S3
Molecular Weight329.48 g/mol
Exact Mass329.01
IUPAC Name4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole
SMILESc1ccn2c(SCc3csc(-c4ccsc4)n3)ncc2c1
InChIInChI=1S/C15H11N3S3/c1-2-5-18-13(3-1)7-16-15(18)21-10-12-9-20-14(17-12)11-4-6-19-8-11/h1-9H,10H2
InChIKeyCJFMMNWFDKHHGY-UHFFFAOYSA-N
XLogP4.81
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.48
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-thiophen-3-yl-1,3-thiazole
CID 8751448
2-[4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-1,3-thiazol-2-yl]-N-phenylacetamide
CID 47942617
4-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-thiophen-3-yl-1,3-thiazole
CID 27931128
4-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-thiophen-3-yl-1,3-thiazole
CID 8841500
4-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-thiophen-3-yl-1,3-thiazole
CID 8880989
4-[[1-(furan-2-ylmethyl)tetrazol-5-yl]sulfanylmethyl]-2-thiophen-3-yl-1,3-thiazole
CID 17457985
2-thiophen-3-yl-4-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole
CID 134010875
4-[(5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanylmethyl]-2-thiophen-3-yl-1,3-thiazole
CID 8747825
4-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]-2-thiophen-3-yl-1,3-thiazole
CID 8684313
4-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole
CID 4171231
4-(bromomethyl)-2-thiophen-3-yl-1,3-thiazole
CID 81222713
4-[[4-(furan-2-ylmethyl)-5-propan-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-thiophen-3-yl-1,3-thiazole
CID 30036894

Frequently Asked Questions

What is the IUPAC name of 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole?
The IUPAC name of 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole (CID 35456975) is 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole.
What is the SMILES notation for 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole?
The canonical SMILES for 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole is c1ccn2c(SCc3csc(-c4ccsc4)n3)ncc2c1.
What is the InChIKey of 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole?
The InChIKey is CJFMMNWFDKHHGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3S3/c1-2-5-18-13(3-1)7-16-15(18)21-10-12-9-20-14(17-12)11-4-6-19-8-11/h1-9H,10H2.
What are the key properties of 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole?
4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole has a molecular weight of 329.48 g/mol, XLogP of 4.81, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(imidazo[1,5-a]pyridin-3-ylsulfanylmethyl)-2-thiophen-3-yl-1,3-thiazole is sourced from PubChem (CID 35456975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).