5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine

C6H5ClN4S — CID 155294310

IUPAC5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine
SMILESCc1nc(Cl)nc2sc(N)nc12
InChIInChI=1S/C6H5ClN4S/c1-2-3-4(11-5(7)9-2)12-6(8)10-3/h1H3,(H2,8,10)
InChIKeyASLBLOXWVHIFDH-UHFFFAOYSA-N
MW200.65 g/mol
LogP1.63
Rot. Bonds

About 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine

5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine (PubChem CID 155294310) has the molecular formula C6H5ClN4S and a molecular weight of 200.65 g/mol. Its IUPAC name is 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine.

Molecular Properties

Compound Name5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine
PubChem CID155294310
Molecular FormulaC6H5ClN4S
Molecular Weight200.65 g/mol
Exact Mass199.99
IUPAC Name5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine
SMILESCc1nc(Cl)nc2sc(N)nc12
InChIInChI=1S/C6H5ClN4S/c1-2-3-4(11-5(7)9-2)12-6(8)10-3/h1H3,(H2,8,10)
InChIKeyASLBLOXWVHIFDH-UHFFFAOYSA-N
XLogP1.63
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.65
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 83828889
2-(1,1-Difluoroethyl)-5,7-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 144818274
2-Fluoro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 169976515
(5,7-Dimethyl-[1,3]thiazolo[5,4-d]pyrimidin-2-yl) thiohypofluorite
CID 169977748
Thiazolo[5,4-d]pyrimidine, 7-methyl-
CID 592047
5-Chloro-7-(trifluoromethyl)[1,3]thiazolo[5,4-d]pyrimidine
CID 243104
5-Chloro-7-methyl-2-(trifluoromethyl)-[1,3]thiazolo[5,4-d]pyrimidine
CID 165994032
2-[[2-(2-Amino-2-oxoethyl)sulfanyl-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-5-yl]sulfanyl]acetamide
CID 326889
5,7-Dimethyl-[1,3]thiazolo[4,5-d]pyrimidin-2-amine
CID 59703738
7-Methyl-[1,3]thiazolo[5,4-d]pyrimidin-5-amine
CID 84021359
2,7-Dimethyl-[1,3]thiazolo[5,4-d]pyrimidin-5-amine
CID 84022317
2-N,7-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-2,5-diamine
CID 87125900

Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine?
The IUPAC name of 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine (CID 155294310) is 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine.
What is the SMILES notation for 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine?
The canonical SMILES for 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine is Cc1nc(Cl)nc2sc(N)nc12.
What is the InChIKey of 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine?
The InChIKey is ASLBLOXWVHIFDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClN4S/c1-2-3-4(11-5(7)9-2)12-6(8)10-3/h1H3,(H2,8,10).
What are the key properties of 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine?
5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine has a molecular weight of 200.65 g/mol, XLogP of 1.63, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine is sourced from PubChem (CID 155294310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).