이름: ethyl 1-(4-amino-3-bromo-5-(cyclopropylmethoxy)phenyl)cyclopentanecarboxylate
SMILES:
CCOC(=O)C1(c2cc(Br)c(N)c(OCC3CC3)c2)CCCC1Molecular Processing
Molecular formula
C18H24BrNO3
Molecular weight
382.3
Exact mass
381.094
XLogP
4.2
TPSA
61.55
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
23
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
93.55
Supplementary Information
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