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85633-19-8 | 1,3,5-Triazin-2-amine, 4-(4-chlorophenyl)-6-(1-pyrrolidinyl)-
CAS No: 85633-19-8 Catalog No: AG004Q78 MDL No:
Product Description
Catalog Number:
AG004Q78
Chemical Name:
1,3,5-Triazin-2-amine, 4-(4-chlorophenyl)-6-(1-pyrrolidinyl)-
CAS Number:
85633-19-8
Molecular Formula:
C13H14ClN5
Molecular Weight:
275.7368
IUPAC Name:
4-(4-chlorophenyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
InChI:
InChI=1S/C13H14ClN5/c14-10-5-3-9(4-6-10)11-16-12(15)18-13(17-11)19-7-1-2-8-19/h3-6H,1-2,7-8H2,(H2,15,16,17,18)
InChI Key:
XPZPARKVGXKXSW-UHFFFAOYSA-N
SMILES:
Nc1nc(nc(n1)N1CCCC1)c1ccc(cc1)Cl
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.094g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.74g/mol
Monoisotopic Mass:
275.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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