Chemical ID: 6808078

Cc1c(cccc1Cl)NC(=S)N(C2CCCCC2)C(C)c3cccnc3
Chemical ID:
6808078
Name [?]:
3-(3-chloro-2-methyl-phenyl)-1-cyclohexyl-1-[1-(3-pyridyl)ethyl]thiourea
SMILES [?]:
Cc1c(cccc1Cl)NC(=S)N(C2CCCCC2)C(C)c3cccnc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H26ClN3S
All Atoms:52
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:12.5119
Area:566.488
Solvation:-1.65036
Coulombic:-27.0273
Bond Count [?]
All:28
Single:21
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:387.97
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.91
LogP (Chemaxon):5.13

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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