CCCC(CSc1ccc(F)cc1)N(CC)C1CCC(c2ccc3[nH]c(=O)oc3c2)CC1
SMILES: CCCC(CSc1ccc(F)cc1)N(CC)C1CCC(c2ccc3[nH]c(=O)oc3c2)CC1

Molecular Processing

Molecular formula
C26H33FN2O2S
Molecular weight
456.63
Exact mass
456.2247
XLogP
6.57
TPSA
49.24
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
130.03

Supplementary Information

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