2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine

C10H8ClN7S — CID 62867228

IUPAC2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine
SMILESCn1cc(Sc2nc(Cl)nc(-n3ccnc3)n2)cn1
InChIInChI=1S/C10H8ClN7S/c1-17-5-7(4-13-17)19-10-15-8(11)14-9(16-10)18-3-2-12-6-18/h2-6H,1H3
InChIKeyRIQATGZLWRNQMS-UHFFFAOYSA-N
MW293.74 g/mol
LogP1.60
Rot. Bonds3

About 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine

2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine (PubChem CID 62867228) has the molecular formula C10H8ClN7S and a molecular weight of 293.74 g/mol. Its IUPAC name is 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine
PubChem CID62867228
Molecular FormulaC10H8ClN7S
Molecular Weight293.74 g/mol
Exact Mass293.03
IUPAC Name2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine
SMILESCn1cc(Sc2nc(Cl)nc(-n3ccnc3)n2)cn1
InChIInChI=1S/C10H8ClN7S/c1-17-5-7(4-13-17)19-10-15-8(11)14-9(16-10)18-3-2-12-6-18/h2-6H,1H3
InChIKeyRIQATGZLWRNQMS-UHFFFAOYSA-N
XLogP1.60
TPSA74.31 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.74
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-{1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-1H-imidazol-2-yl}-2-(propylthio)pyrimidine
CID 56873927
2-(propylthio)-5-{1-[2-(1H-pyrazol-1-yl)ethyl]-1H-imidazol-2-yl}pyrimidine
CID 56875783
5-Methylsulfanyl-2-(triazol-2-yl)pyrimidine
CID 169575848
2-(4-Methylsulfanylimidazol-1-yl)pyrimidine
CID 174476045
2,4-bis[(1-methyl-1H-imidazol-2-yl)sulfanyl]pyrimidine
CID 45035607
2-Chloro-4-imidazol-1-yl-6-(4-methylpyrazol-1-yl)-1,3,5-triazine
CID 55124917
4-chloro-N,N-dimethyl-5-{1-[2-(1H-pyrazol-1-yl)ethyl]-1H-imidazol-2-yl}-1,3-thiazol-2-amine
CID 56874356
2-(1-Methylpyrazol-4-yl)sulfanylpyrimidin-5-amine
CID 61384698
2-Chloro-4-(1-methylpyrazol-4-yl)sulfanylpyrimidine
CID 62343480
4-chloro-N-methyl-6-pyrazol-1-yl-N-(1,3-thiazol-4-ylmethyl)-1,3,5-triazin-2-amine
CID 62862930
2-Chloro-4-imidazol-1-yl-6-pyrazol-1-yl-1,3,5-triazine
CID 62863484
4-chloro-6-imidazol-1-yl-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3,5-triazin-2-amine
CID 62864080

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine?
The IUPAC name of 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine (CID 62867228) is 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine?
The canonical SMILES for 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine is Cn1cc(Sc2nc(Cl)nc(-n3ccnc3)n2)cn1.
What is the InChIKey of 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine?
The InChIKey is RIQATGZLWRNQMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN7S/c1-17-5-7(4-13-17)19-10-15-8(11)14-9(16-10)18-3-2-12-6-18/h2-6H,1H3.
What are the key properties of 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine?
2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine has a molecular weight of 293.74 g/mol, XLogP of 1.60, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-imidazol-1-yl-6-(1-methylpyrazol-4-yl)sulfanyl-1,3,5-triazine is sourced from PubChem (CID 62867228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).