이름: 6-methoxy-N-(3-methylphenyl)-7-(2-morpholin-4-ylethoxy)quinazolin-4-amine
SMILES:
CC1=CC(=CC=C1)NC2=NC=NC3=CC(=C(C=C32)OC)OCCN4CCOCC4Molecular Processing
Molecular formula
C22H26N4O3
Molecular weight
394.48
Exact mass
394.2005
XLogP
3.4
TPSA
68.74
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
113.31
Supplementary Information
InChIKey: KKAHSVDGWDURSJ-UHFFFAOYSA-N
동의어
SCHEMBL8870721KKAHSVDGWDURSJ-UHFFFAOYSA-N6-methoxy-4-(3'-methylanilino)-7-(2-morpholinoethoxy)quinazoline
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