Chemical ID: 3843578

CCn1c(nnc1SCC(=O)Nc2ccccc2Cl)c3ccccc3OC
Chemical ID:
3843578
Name [?]:
N-(2-chlorophenyl)-2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
CCn1c(nnc1SCC(=O)Nc2ccccc2Cl)c3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H19ClN4O2S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.3321
Area:620.6
Solvation:-4.18289
Coulombic:-41.6995
Bond Count [?]
All:29
Single:20
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:402.899
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.49
LogP (Chemaxon):3.25

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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