이름: dimethyl 4-[2-(2-aminoethoxy)-5-nitrophenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
SMILES:
COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1cc([N+](=O)[O-])ccc1OCCNMolecular Processing
Molecular formula
C19H23N3O7
Molecular weight
405.41
Exact mass
405.1536
XLogP
1.51
TPSA
143.02
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
29
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
102.95
Supplementary Information
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