COc1cc2nc(N(C)CCC#N)nc(N)c2cc1OC.Cl
이름: N-(4-amino-6,7-dimethoxyquinazol-2-yl)-N-methyl-2-cyanoethylamine hydrochloride
SMILES: COc1cc2nc(N(C)CCC#N)nc(N)c2cc1OC.Cl

Molecular Processing

Molecular formula
C14H18ClN5O2
Molecular weight
323.78
Exact mass
323.1149
XLogP
2
TPSA
97.29
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.357
Molar refractivity
87.8

Supplementary Information

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