CC1(c2ccc3c(Cl)c(OC4CCC(C(C)(C)C)CC4)ccc3c2)COC(=O)N1
SMILES: CC1(c2ccc3c(Cl)c(OC4CCC(C(C)(C)C)CC4)ccc3c2)COC(=O)N1

Molecular Processing

Molecular formula
C24H30ClNO3
Molecular weight
415.96
Exact mass
415.1914
XLogP
6.43
TPSA
47.56
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
29
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.542
Molar refractivity
116.62

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt