Name: 7-(2-chloro-5-methoxy-phenyl)-6-methyl-benzo[1,2,4]triazin-3-ylamine
SMILES:
COc1ccc(Cl)c(-c2cc3nnc(N)nc3cc2C)c1Molecular Processing
Molecular formula
C15H13ClN4O
Molecular weight
300.75
Exact mass
300.0778
XLogP
3.24
TPSA
73.92
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
83.48
Supplementary Information
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