CC1CCC(CC1)CN2C=NC3=CC(=NC(=C32)Cl)Cl
Name: 4,6-dichloro-3-[(4-methylcyclohexyl)methyl]imidazo[4,5-c]pyridine
SMILES: CC1CCC(CC1)CN2C=NC3=CC(=NC(=C32)Cl)Cl

Molecular Processing

Molecular formula
C14H17Cl2N3
Molecular weight
298.22
Exact mass
297.08
XLogP
4.56
TPSA
30.71
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
78.67

Supplementary Information

InChIKey: CYQLONYTEPSRAE-UHFFFAOYSA-N
Synonyme
4,6-dichloro-3-((trans-4-methylcyclohexyl)methyl)-3H-imidazo[4,5-c]pyridine4,6-dichloro-3-[(trans-4-methylcyclohexyl)methyl]-3H-imidazo[4,5-c]pyridineSCHEMBL15817572SCHEMBL15817575CYQLONYTEPSRAE-MGCOHNPYSA-N
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