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30368-93-5 | 1,3,5-Triazine-2,4-diamine, N2,N4-bis(4-chlorophenyl)-6-methyl-
CAS No: 30368-93-5 Catalog No: AG002ZVQ MDL No:
Product Description
Catalog Number:
AG002ZVQ
Chemical Name:
1,3,5-Triazine-2,4-diamine, N2,N4-bis(4-chlorophenyl)-6-methyl-
CAS Number:
30368-93-5
Molecular Formula:
C16H13Cl2N5
Molecular Weight:
346.2139
IUPAC Name:
2-N,2-N-bis(4-chlorophenyl)-6-methyl-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C16H13Cl2N5/c1-10-20-15(19)22-16(21-10)23(13-6-2-11(17)3-7-13)14-8-4-12(18)5-9-14/h2-9H,1H3,(H2,19,20,21,22)
InChI Key:
CQHIEUZVKNMMLB-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Nc1nc(Nc2ccc(cc2)Cl)nc(n1)C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.055g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
346.215g/mol
Monoisotopic Mass:
345.055g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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