2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine

C13H12ClN5S — CID 103321606

IUPAC2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine
SMILESCc1cc2c(N3CCn4ccnc4C3)nc(Cl)nc2s1
InChIInChI=1S/C13H12ClN5S/c1-8-6-9-11(16-13(14)17-12(9)20-8)19-5-4-18-3-2-15-10(18)7-19/h2-3,6H,4-5,7H2,1H3
InChIKeyWREPMFSNJDOOGN-UHFFFAOYSA-N
MW305.79 g/mol
LogP2.87
Rot. Bonds1

About 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine

2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine (PubChem CID 103321606) has the molecular formula C13H12ClN5S and a molecular weight of 305.79 g/mol. Its IUPAC name is 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine.

Molecular Properties

Compound Name2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine
PubChem CID103321606
Molecular FormulaC13H12ClN5S
Molecular Weight305.79 g/mol
Exact Mass305.05
IUPAC Name2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine
SMILESCc1cc2c(N3CCn4ccnc4C3)nc(Cl)nc2s1
InChIInChI=1S/C13H12ClN5S/c1-8-6-9-11(16-13(14)17-12(9)20-8)19-5-4-18-3-2-15-10(18)7-19/h2-3,6H,4-5,7H2,1H3
InChIKeyWREPMFSNJDOOGN-UHFFFAOYSA-N
XLogP2.87
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.79
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,6-dimethylthieno[2,3-d]pyrimidin-2-amine
CID 103327562
7-(2-chloro-5-methylpyrimidin-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 79073104
4-(azetidin-1-yl)-2-chloro-6-methylthieno[2,3-d]pyrimidine
CID 130547955
2-chloro-4-(3,4-dimethylpyrrolidin-1-yl)-6-methylthieno[2,3-d]pyrimidine
CID 103322044
2-chloro-4-(4,4-dimethylazepan-1-yl)-6-methylthieno[2,3-d]pyrimidine
CID 103321928
4-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103328315
3,5-dichloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-methylpyridin-2-amine
CID 102758125
5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine
CID 80831106
4-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,N-dimethyl-1,3,5-triazin-2-amine
CID 55144623
[4-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazol-5-yl]methanol
CID 80692602
1-(2-chloro-6-methylthieno[2,3-d]pyrimidin-4-yl)-N,N-dimethylpiperidin-3-amine
CID 103321991
7-(3-bromo-4-methyl-2-pyridinyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 106877064

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine?
The IUPAC name of 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine (CID 103321606) is 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine.
What is the SMILES notation for 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine?
The canonical SMILES for 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine is Cc1cc2c(N3CCn4ccnc4C3)nc(Cl)nc2s1.
What is the InChIKey of 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine?
The InChIKey is WREPMFSNJDOOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN5S/c1-8-6-9-11(16-13(14)17-12(9)20-8)19-5-4-18-3-2-15-10(18)7-19/h2-3,6H,4-5,7H2,1H3.
What are the key properties of 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine?
2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine has a molecular weight of 305.79 g/mol, XLogP of 2.87, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidine is sourced from PubChem (CID 103321606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).