CC1=NC2=C(C=C(C=C2)CN)C(=O)N1C3CCC(=O)NC3=O
이름: 3-[6-(aminomethyl)-2-methyl-4-oxoquinazolin-3-yl]piperidine-2,6-dione
SMILES: CC1=NC2=C(C=C(C=C2)CN)C(=O)N1C3CCC(=O)NC3=O

Molecular Processing

Molecular formula
C15H16N4O3
Molecular weight
300.32
Exact mass
300.1222
XLogP
0.14
TPSA
107.08
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
80.05

Supplementary Information

InChIKey: CMZMLIGJFADBTI-UHFFFAOYSA-N
동의어
SCHEMBL3650224EN300-433601283-[6-(aminomethyl)-2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl]piperidine-2,6-dione
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