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1196157-06-8 | Pyrido[3,4-d]pyrimidine, 4-chloro-5,6,7,8-tetrahydro-
CAS No: 1196157-06-8 Catalog No: AG000PCE MDL No:MFCD11520385
Product Description
Catalog Number:
AG000PCE
Chemical Name:
Pyrido[3,4-d]pyrimidine, 4-chloro-5,6,7,8-tetrahydro-
CAS Number:
1196157-06-8
Molecular Formula:
C7H8ClN3
Molecular Weight:
169.6115
MDL Number:
MFCD11520385
IUPAC Name:
4-chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
InChI:
InChI=1S/C7H8ClN3/c8-7-5-1-2-9-3-6(5)10-4-11-7/h4,9H,1-3H2
InChI Key:
NJOMQJJBIYKCLG-UHFFFAOYSA-N
SMILES:
Clc1ncnc2c1CCNC2
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.041g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.612g/mol
Monoisotopic Mass:
169.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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