Chemical ID: 4122353

CC(c1ccc(cc1)OC)NCc2cccs2
Chemical ID:
4122353
Name [?]:
1-(4-methoxyphenyl)-N-(2-thienylmethyl)ethanamine
SMILES [?]:
CC(c1ccc(cc1)OC)NCc2cccs2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H17NOS
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:8.5879
Area:454.384
Solvation:-2.7717
Coulombic:-18.2143
Bond Count [?]
All:18
Single:13
Double:5
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:247.357
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.75
LogP (Chemaxon):2.92

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