Chemical ID: 6710993

COc1ccc(cc1)C[NH2+]Cc2ccc(cc2)SC
Chemical ID:
6710993
Name [?]:
(4-methoxyphenyl)methyl-[(4-methylsulfanylphenyl)methyl]ammonium
SMILES [?]:
COc1ccc(cc1)C[NH2+]Cc2ccc(cc2)SC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H20NOS+
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:-24.1822
Area:500.027
Solvation:-36.6829
Coulombic:26.9854
Bond Count [?]
All:20
Single:14
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:274.402
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:3.9
LogP (Chemaxon):3.75

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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