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Home > Bromides > 1227958-17-9
1227958-17-9 | Pyrido[2,3-d]pyrimidine, 7-(bromomethyl)-2-chloro-4-(4-morpholinyl)-
CAS No: 1227958-17-9 Catalog No: AG000JHG MDL No:MFCD21648265
Product Description
Catalog Number:
AG000JHG
Chemical Name:
Pyrido[2,3-d]pyrimidine, 7-(bromomethyl)-2-chloro-4-(4-morpholinyl)-
CAS Number:
1227958-17-9
Molecular Formula:
C12H12BrClN4O
Molecular Weight:
343.6069
MDL Number:
MFCD21648265
IUPAC Name:
4-[7-(bromomethyl)-2-chloropyrido[2,3-d]pyrimidin-4-yl]morpholine
InChI:
InChI=1S/C12H12BrClN4O/c13-7-8-1-2-9-10(15-8)16-12(14)17-11(9)18-3-5-19-6-4-18/h1-2H,3-7H2
InChI Key:
QWKYGOMPVPPFDV-UHFFFAOYSA-N
SMILES:
BrCc1ccc2c(n1)nc(nc2N1CCOCC1)Cl
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.988g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.609g/mol
Monoisotopic Mass:
341.988g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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