4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine

C15H10N4S3 — CID 86076412

IUPAC4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine
SMILESc1csc(-c2ccc(Nc3nc(-c4nccs4)cs3)nc2)c1
InChIInChI=1S/C15H10N4S3/c1-2-12(20-6-1)10-3-4-13(17-8-10)19-15-18-11(9-22-15)14-16-5-7-21-14/h1-9H,(H,17,18,19)
InChIKeyBVFDZWLZGMFUHM-UHFFFAOYSA-N
MW342.47 g/mol
LogP5.13
Rot. Bonds4

About 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine

4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine (PubChem CID 86076412) has the molecular formula C15H10N4S3 and a molecular weight of 342.47 g/mol. Its IUPAC name is 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine
PubChem CID86076412
Molecular FormulaC15H10N4S3
Molecular Weight342.47 g/mol
Exact Mass342.01
IUPAC Name4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine
SMILESc1csc(-c2ccc(Nc3nc(-c4nccs4)cs3)nc2)c1
InChIInChI=1S/C15H10N4S3/c1-2-12(20-6-1)10-3-4-13(17-8-10)19-15-18-11(9-22-15)14-16-5-7-21-14/h1-9H,(H,17,18,19)
InChIKeyBVFDZWLZGMFUHM-UHFFFAOYSA-N
XLogP5.13
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.47
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine with MolForge

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Related Compounds

N-pyrimidin-2-yl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrobromide
CID 5344926
N-(3-chlorophenyl)-4-(1,3-thiazol-2-yl)-1,3-thiazol-2-amine
CID 163214642
N-(2,4-difluorophenyl)-4-(1,3-thiazol-2-yl)-1,3-thiazol-2-amine
CID 163214646
N-(3-methoxyphenyl)-4-(1,3-thiazol-2-yl)-1,3-thiazol-2-amine
CID 163214674
4-(4-fluorophenyl)-N-(5-methyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 972745
N-(6-chloro-2-methylpyrimidin-4-yl)-4-thiophen-2-yl-1,3-thiazol-2-amine
CID 108777084
4-[4-(2,2-dimethylpropylamino)phenyl]-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 122499792
N-(5-propyl-2-pyridinyl)-6-(1,3-thiazol-2-yl)pyridin-2-amine
CID 174524706
N-(2-chloro-6-methylpyrimidin-4-yl)-4-thiophen-2-yl-1,3-thiazol-2-amine
CID 108777078
N-methyl-4-(2-thiophen-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-amine
CID 82424491
N-(4-piperazin-1-ylphenyl)-4-(1,3-thiazol-2-yl)-1,3-thiazol-2-amine
CID 163214659
[6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol
CID 69231355

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine (CID 86076412) is 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine is c1csc(-c2ccc(Nc3nc(-c4nccs4)cs3)nc2)c1.
What is the InChIKey of 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine?
The InChIKey is BVFDZWLZGMFUHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4S3/c1-2-12(20-6-1)10-3-4-13(17-8-10)19-15-18-11(9-22-15)14-16-5-7-21-14/h1-9H,(H,17,18,19).
What are the key properties of 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine?
4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine has a molecular weight of 342.47 g/mol, XLogP of 5.13, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-thiazol-2-yl)-N-(5-thiophen-2-yl-2-pyridinyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 86076412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).