CC1CN(C(CN1CC2=CC=C(C=C2)Cl)C)CCCCl
الاسم: 1-[(4-chlorophenyl)methyl]-4-(3-chloropropyl)-2,5-dimethylpiperazine
SMILES: CC1CN(C(CN1CC2=CC=C(C=C2)Cl)C)CCCCl

Molecular Processing

Molecular formula
C16H24Cl2N2
Molecular weight
315.29
Exact mass
314.1317
XLogP
3.86
TPSA
6.48
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
87.7

Supplementary Information

InChIKey: TYTJYXHYLDTDAU-UHFFFAOYSA-N
مرادفات
SCHEMBL10664305TYTJYXHYLDTDAU-UHFFFAOYSA-N1-(4-chlorobenzyl)-2,5-dimethyl-4-(3-chloropropyl)piperazine
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