이름: ethyl 2-(8-chloro-1,2,3,4-tetrahydro-2-methylpyrido[4,3-b]indol-5-yl)acetate
SMILES:
CCOC(=O)Cn1c2c(c3cc(Cl)ccc31)CN(C)CC2Molecular Processing
Molecular formula
C16H19ClN2O2
Molecular weight
306.79
Exact mass
306.1135
XLogP
2.85
TPSA
34.47
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
83.62
Supplementary Information
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