이름: 2-(2-phenylchroman-6-yloxy)-5-trifluoromethylbenzene-1,3-diamine
SMILES:
Nc1cc(C(F)(F)F)cc(N)c1Oc1ccc2c(c1)CCC(c1ccccc1)O2Molecular Processing
Molecular formula
C22H19F3N2O2
Molecular weight
400.4
Exact mass
400.1399
XLogP
5.73
TPSA
70.5
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
104.92
Supplementary Information
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