Chemical ID: 6809463

CC(c1ccc[nH+]c1)N(C2CCCCC2)C(=S)Nc3ccccc3OC
Chemical ID:
6809463
Name [?]:
1-cyclohexyl-3-(2-methoxyphenyl)-1-[1-(1H-pyridin-5-yl)ethyl]thiourea
SMILES [?]:
CC(c1ccc[nH+]c1)N(C2CCCCC2)C(=S)Nc3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H28N3OS+
All Atoms:54
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:-19.8579
Area:551.204
Solvation:-33.638
Coulombic:-21.8699
Bond Count [?]
All:28
Single:21
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:370.533
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.98
LogP (Chemaxon):4.54

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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