CCCNC(=O)NCCn1c(COCC)nc2cnc3cc(Br)ccc3c21
SMILES: CCCNC(=O)NCCn1c(COCC)nc2cnc3cc(Br)ccc3c21

Molecular Processing

Molecular formula
C19H24BrN5O2
Molecular weight
434.34
Exact mass
433.1113
XLogP
3.59
TPSA
81.07
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.421
Molar refractivity
109.76

Supplementary Information

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