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871266-86-3 | Thiazolo[5,4-d]pyrimidin-2-amine,7-chloro-N-(1-methylethyl)-
CAS No: 871266-86-3 Catalog No: AG004KPP MDL No:
Product Description
Catalog Number:
AG004KPP
Chemical Name:
Thiazolo[5,4-d]pyrimidin-2-amine,7-chloro-N-(1-methylethyl)-
CAS Number:
871266-86-3
Molecular Formula:
C8H9ClN4S
Molecular Weight:
228.7019
IUPAC Name:
7-chloro-N-propan-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-2-amine
InChI:
InChI=1S/C8H9ClN4S/c1-4(2)12-8-13-5-6(9)10-3-11-7(5)14-8/h3-4H,1-2H3,(H,12,13)
InChI Key:
MRQQYAMBJJWLRQ-UHFFFAOYSA-N
SMILES:
CC(Nc1sc2c(n1)c(Cl)ncn2)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.024g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.698g/mol
Monoisotopic Mass:
228.024g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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