Chemical ID: 4376984

CCc1ccc(cc1)CN2CCN(CC2)Cc3ccc(cc3)SC
Chemical ID:
4376984
Name [?]:
1-[(4-ethylphenyl)methyl]-4-[(4-methylsulfanylphenyl)methyl]piperazine
SMILES [?]:
CCc1ccc(cc1)CN2CCN(CC2)Cc3ccc(cc3)SC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H28N2S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:12.2745
Area:579.468
Solvation:-2.21224
Coulombic:-13.5227
Bond Count [?]
All:26
Single:20
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:340.526
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.77
LogP (Chemaxon):5.03

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue