CC(C)C1C2C(C(=O)N1Cc1ccc3c(c1)OCO3)C(c1ccc(C(=N)NO)cc1)N(C)C2(C)C
SMILES: CC(C)C1C2C(C(=O)N1Cc1ccc3c(c1)OCO3)C(c1ccc(C(=N)NO)cc1)N(C)C2(C)C

Molecular Processing

Molecular formula
C27H34N4O4
Molecular weight
478.59
Exact mass
478.258
XLogP
3.78
TPSA
98.12
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.481
Molar refractivity
131.5

Supplementary Information

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