الاسم: methyl 4-methyl-2-phenyl-6-(3-nitrophenyl)-1,6-dihydro-5-pyrimidinecarboxylate
SMILES:
COC(=O)C1=C(C)N=C(c2ccccc2)NC1c1cccc([N+](=O)[O-])c1Molecular Processing
Molecular formula
C19H17N3O4
Molecular weight
351.36
Exact mass
351.1219
XLogP
3.13
TPSA
93.83
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
96.67
Supplementary Information
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