이름: (Z)-2-(2-tritylaminothiazol-4-yl)-2-[(2-pyrrolidon-3-yl)oxyimino]acetic acid
SMILES:
O=C(O)/C(=N\OC1CCNC1=O)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1Molecular Processing
Molecular formula
C28H24N4O4S
Molecular weight
512.59
Exact mass
512.1518
XLogP
4.24
TPSA
112.91
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
37
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
141.62
Supplementary Information
No supplementary data available
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