Chemical ID: 5299255

Cc1ccc(cc1)c2nnc(n2c3ccc(cc3)C)SCC(=O)Nc4ccc5c(c4)OCCO5
Chemical ID:
5299255
Name [?]:
2-[[4,5-bis(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-yl)acetamide
SMILES [?]:
Cc1ccc(cc1)c2nnc(n2c3ccc(cc3)C)SCC(=O)Nc4ccc5c(c4)OCCO5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H24N4O3S
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:13.1928
Area:705.459
Solvation:-4.44373
Coulombic:-50.4343
Bond Count [?]
All:38
Single:26
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:472.56
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:6.59
LogP (Chemaxon):4.96

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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