COC(=O)NC1=NCC(c2c(Cl)cccc2Cl)N1
SMILES: COC(=O)NC1=NCC(c2c(Cl)cccc2Cl)N1

Molecular Processing

Molecular formula
C11H11Cl2N3O2
Molecular weight
288.13
Exact mass
287.0228
XLogP
2.35
TPSA
62.72
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
70.18

Supplementary Information

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