الاسم: 5-(methyl-propylcarbamoyl)-isophthalic acid 1-ethyl ester 3-isopropyl ester
SMILES:
CCCN(C)C(=O)c1cc(C(=O)OCC)cc(C(=O)OC(C)C)c1Molecular Processing
Molecular formula
C18H25NO5
Molecular weight
335.4
Exact mass
335.1733
XLogP
2.91
TPSA
72.91
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
90.2
Supplementary Information
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