الاسم: starting material XXV
SMILES:
CC1Cc2cc3c(cc2C(c2ccc([N+](=O)[O-])cc2)=NN1C(=O)NCCCl)OCO3Molecular Processing
Molecular formula
C20H19ClN4O5
Molecular weight
430.85
Exact mass
430.1044
XLogP
3.27
TPSA
106.3
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
110.42
Supplementary Information
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