7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine

C8H8ClN3S — CID 126739563

IUPAC7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine
SMILESCSc1nc(Cl)c(C)c2nccn12
InChIInChI=1S/C8H8ClN3S/c1-5-6(9)11-8(13-2)12-4-3-10-7(5)12/h3-4H,1-2H3
InChIKeyHKBNNQJBPUHAQM-UHFFFAOYSA-N
MW213.69 g/mol
LogP2.41
Rot. Bonds1

About 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine

7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine (PubChem CID 126739563) has the molecular formula C8H8ClN3S and a molecular weight of 213.69 g/mol. Its IUPAC name is 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Name7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine
PubChem CID126739563
Molecular FormulaC8H8ClN3S
Molecular Weight213.69 g/mol
Exact Mass213.01
IUPAC Name7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine
SMILESCSc1nc(Cl)c(C)c2nccn12
InChIInChI=1S/C8H8ClN3S/c1-5-6(9)11-8(13-2)12-4-3-10-7(5)12/h3-4H,1-2H3
InChIKeyHKBNNQJBPUHAQM-UHFFFAOYSA-N
XLogP2.41
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.69
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5,7-Dichloroimidazo[1,2-c]pyrimidine
CID 46942117
6-Chloro-2-[(1-methylimidazol-2-yl)methylsulfanyl]pyrimidin-4-amine
CID 492737
7-Chloro-8-methylimidazo(1,2-c)pyrimidine
CID 134818686
7-Chloro-5-(methylthio)-2-(trifluoromethyl)imidazo[1,2-c]pyrimidine
CID 59313017
2,7-Dichloro-5-(methylsulfanyl)imidazo[1,2-c]pyrimidine
CID 250909
2,7-Dichloro-n,n-dimethylimidazo[1,2-c]pyrimidin-5-amine
CID 280331
N-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidin-7-amine
CID 11819955
N-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidin-7-amine;hydrochloride
CID 13394202
7-(4-Methyl-1-piperazinyl)-5-(methylthio)imidazo[1,2-c]pyrimidine
CID 13394215
7-(4-Methylpiperazin-1-yl)-5-methylsulfanylimidazo[1,2-c]pyrimidine;hydrochloride
CID 13394216
7-(4-Methylpiperazin-1-yl)-5-methylsulfanylimidazo[1,2-c]pyrimidine;hydrate;hydrochloride
CID 20250316
5-Methylsulfanyl-7-piperidin-1-ylimidazo[1,2-c]pyrimidine
CID 20250319

Frequently Asked Questions

What is the IUPAC name of 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine?
The IUPAC name of 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine (CID 126739563) is 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine.
What is the SMILES notation for 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine?
The canonical SMILES for 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine is CSc1nc(Cl)c(C)c2nccn12.
What is the InChIKey of 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine?
The InChIKey is HKBNNQJBPUHAQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3S/c1-5-6(9)11-8(13-2)12-4-3-10-7(5)12/h3-4H,1-2H3.
What are the key properties of 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine?
7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine has a molecular weight of 213.69 g/mol, XLogP of 2.41, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-8-methyl-5-methylsulfanylimidazo[1,2-c]pyrimidine is sourced from PubChem (CID 126739563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).