الاسم: diethyl 4-(6-methylbenzothiazol-2-yl)benzylphosphonate
SMILES:
CCOP(=O)(Cc1ccc(-c2nc3ccc(C)cc3s2)cc1)OCCMolecular Processing
Molecular formula
C19H22NO3PS
Molecular weight
375.43
Exact mass
375.1058
XLogP
6.04
TPSA
48.42
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
25
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
0.316
Molar refractivity
104.36
Supplementary Information
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