Clc1nc(Cl)c2c(n1)CCN(Cc1ccccc1)C2
Name: 6-benzyl-2,4-dichloro-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
SMILES: Clc1nc(Cl)c2c(n1)CCN(Cc1ccccc1)C2

Molecular Processing

Molecular formula
C14H13Cl2N3
Molecular weight
294.19
Exact mass
293.0487
XLogP
3.34
TPSA
29.02
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
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
0.286
Molar refractivity
76.31

Supplementary Information

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