Nom: 3,3-dimethyl-2-(5-morpholin-4-yl-3-pyridinyl)-2,4-dihydro-1H-quinoline-6-carboxylic acid
SMILES:
CC1(C)Cc2cc(C(=O)O)ccc2NC1c1cncc(N2CCOCC2)c1Molecular Processing
Molecular formula
C21H25N3O3
Molecular weight
367.45
Exact mass
367.1896
XLogP
3.35
TPSA
74.69
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
104.52
Supplementary Information
InChIKey: RQDBGRSWKYICEU-UHFFFAOYSA-N
Synonymes
SCHEMBL2537669RQDBGRSWKYICEU-UHFFFAOYSA-N3,3-dimethyl-2-(5-morpholin-4-yl-pyridin-3-yl)-1,2,3,4-tetrahydro-quinoline-6-carboxylic acid
Impliqué dans 6 réactions→