Chemical ID: 4644400

CCC(C)CC1(NC(=S)N(N1)c2ccccc2)CC
Chemical ID:
4644400
Name [?]:
5-ethyl-5-(2-methylbutyl)-2-phenyl-1,2,4-triazolidine-3-thione
SMILES [?]:
CCC(C)CC1(NC(=S)N(N1)c2ccccc2)CC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H23N3S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:2
ZAP Information [?]
Total:10.4861
Area:461.297
Solvation:-1.04632
Coulombic:-25.2593
Bond Count [?]
All:20
Single:16
Double:4
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:277.429
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:4.97
LogP (Chemaxon):4.76

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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