이름: benzhydryl 7-amino-3-(2,2-dichlorovinyl)-3-cephem-4-carboxylate hydrochloride
SMILES:
Cl.NC1C(=O)N2C(C(=O)OC(c3ccccc3)c3ccccc3)=C(C=C(Cl)Cl)CS[C@H]12Molecular Processing
Molecular formula
C22H19Cl3N2O3S
Molecular weight
497.83
Exact mass
496.0182
XLogP
4.56
TPSA
72.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
31
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.182
Molar refractivity
125.95
Supplementary Information
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