CC(C)(C)OC(=O)NCCCN(CCCc1ccccc1)S(=O)(=O)c1cccc2c(N)nccc12
이름: Intermediate 14
SMILES: CC(C)(C)OC(=O)NCCCN(CCCc1ccccc1)S(=O)(=O)c1cccc2c(N)nccc12

Molecular Processing

Molecular formula
C26H34N4O4S
Molecular weight
498.65
Exact mass
498.2301
XLogP
4.36
TPSA
114.62
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
138.53

Supplementary Information

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