Chemical ID: 6446509

CCn1c(nnc1SCCOc2ccccc2Cl)Cc3ccccc3
Chemical ID:
6446509
Name [?]:
3-benzyl-5-[2-(2-chlorophenoxy)ethylsulfanyl]-4-ethyl-1,2,4-triazole
SMILES [?]:
CCn1c(nnc1SCCOc2ccccc2Cl)Cc3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H20ClN3OS
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:12.1072
Area:607.883
Solvation:-3.08987
Coulombic:-22.7822
Bond Count [?]
All:27
Single:19
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:373.9
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:6.58
LogP (Chemaxon):4.6

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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