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1375301-46-4 | 5H-Pyrrolo[3,2-d]pyrimidin-4-amine, 2-chloro-N,N-dimethyl-
CAS No: 1375301-46-4 Catalog No: AG0013IP MDL No:
Product Description
Catalog Number:
AG0013IP
Chemical Name:
5H-Pyrrolo[3,2-d]pyrimidin-4-amine, 2-chloro-N,N-dimethyl-
CAS Number:
1375301-46-4
Molecular Formula:
C8H9ClN4
Molecular Weight:
196.6369
IUPAC Name:
2-chloro-N,N-dimethyl-5H-pyrrolo[3,2-d]pyrimidin-4-amine
InChI:
InChI=1S/C8H9ClN4/c1-13(2)7-6-5(3-4-10-6)11-8(9)12-7/h3-4,10H,1-2H3
InChI Key:
CSRKLYDYSRXAAB-UHFFFAOYSA-N
SMILES:
Clc1nc(N(C)C)c2c(n1)cc[nH]2
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.052g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.638g/mol
Monoisotopic Mass:
196.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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