名称: 5-(2,4-dichlorophenyl)-N-(4-ethoxypyrrolidin-3-yl)-3,6-diethylpyrazin-2-amine

SMILES: CCC1=C(N=C(C(=N1)NC2CNCC2OCC)CC)C3=C(C=C(C=C3)Cl)Cl

Molecular Processing

Molecular formula

C20H26Cl2N4O

Molecular weight

409.36

Exact mass

408.1484

XLogP

4.36

TPSA

59.07

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.5

Molar refractivity

111.94

Supplementary Information

InChIKey: QZJHJAKFQPREKW-UHFFFAOYSA-N

同義語

SCHEMBL6099518