Chemical ID: 5387527

CCn1c(nnc1SCC(=O)Nc2ccccc2C)COc3ccc(cc3)OC
Chemical ID:
5387527
Name [?]:
2-[[4-ethyl-5-[(4-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(o-tolyl)acetamide
SMILES [?]:
CCn1c(nnc1SCC(=O)Nc2ccccc2C)COc3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H24N4O3S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:10.8983
Area:659.905
Solvation:-5.59936
Coulombic:-47.2473
Bond Count [?]
All:31
Single:22
Double:9
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:412.506
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.78
LogP (Chemaxon):2.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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