Chemical ID: 5300865

CCN(CC)C(=O)CSc1nnc(n1c2ccc(cc2)OC)c3ccc(cc3)OC
Chemical ID:
5300865
Name [?]:
2-[[4,5-bis(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-acetamide
SMILES [?]:
CCN(CC)C(=O)CSc1nnc(n1c2ccc(cc2)OC)c3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H26N4O3S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:11.3589
Area:665.093
Solvation:-5.2684
Coulombic:-43.2525
Bond Count [?]
All:32
Single:23
Double:9
Rotors:10
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:426.533
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:5.35
LogP (Chemaxon):2.97

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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