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1375301-63-5 | 5H-Pyrrolo[3,2-d]pyrimidine, 2-chloro-5-methyl-4-(4-morpholinyl)-
CAS No: 1375301-63-5 Catalog No: AG0013IO MDL No:
Product Description
Catalog Number:
AG0013IO
Chemical Name:
5H-Pyrrolo[3,2-d]pyrimidine, 2-chloro-5-methyl-4-(4-morpholinyl)-
CAS Number:
1375301-63-5
Molecular Formula:
C11H13ClN4O
Molecular Weight:
252.7001
IUPAC Name:
4-(2-chloro-5-methylpyrrolo[3,2-d]pyrimidin-4-yl)morpholine
InChI:
InChI=1S/C11H13ClN4O/c1-15-3-2-8-9(15)10(14-11(12)13-8)16-4-6-17-7-5-16/h2-3H,4-7H2,1H3
InChI Key:
VOTNNNUPDZAGGY-UHFFFAOYSA-N
SMILES:
Clc1nc(N2CCOCC2)c2c(n1)ccn2C
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.078g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.702g/mol
Monoisotopic Mass:
252.078g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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