Chemical ID: 3874830

COCCn1c(nnc1SCC(=O)Nc2ccc(cc2)OC)c3ccco3
Chemical ID:
3874830
Name [?]:
2-[[5-(2-furyl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)-acetamide
SMILES [?]:
COCCn1c(nnc1SCC(=O)Nc2ccc(cc2)OC)c3ccco3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H20N4O4S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.48932
Area:625.569
Solvation:-6.14992
Coulombic:-54.8055
Bond Count [?]
All:29
Single:21
Double:8
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:388.442
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.96
LogP (Chemaxon):1.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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