이름: 5-(3-bromophenyl)-2,8-dimethyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
SMILES:
Cc1ccc2c(c1)c1c(n2-c2cccc(Br)c2)CCN(C)C1Molecular Processing
Molecular formula
C19H19BrN2
Molecular weight
355.28
Exact mass
354.0732
XLogP
4.69
TPSA
8.17
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
95.75
Supplementary Information
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