SMILES:
CC(C)(C)OC(=O)N1CCC(COCC(NC(=O)c2ccc3c(Cl)c[nH]c3c2)c2ccccn2)CC1Molecular Processing
Molecular formula
C27H33ClN4O4
Molecular weight
513.04
Exact mass
512.219
XLogP
5.35
TPSA
96.55
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
36
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
139.1
Supplementary Information
Загрузка подробностей…
Участвует в 2 реакциях→