名称: 3-(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)-8-oxa-3-azabicyclo[3.2.1]octane
SMILES:
Clc1nc(N2CCOCC2)nc(N2CC3CCC(C2)O3)n1Molecular Processing
Molecular formula
C13H18ClN5O2
Molecular weight
311.77
Exact mass
311.1149
XLogP
0.73
TPSA
63.61
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
2
Heavy atoms
21
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.769
Molar refractivity
77.98
Supplementary Information
詳細情報を取得中…
15 件の反応に参加→