Chemical ID: 4134898

COc1ccc(cc1)n2c(nnc2SCC(=O)Nc3cccc4c3cccc4)COc5ccccc5
Chemical ID:
4134898
Name [?]:
2-[[4-(4-methoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1-naphthyl)acetamide
SMILES [?]:
COc1ccc(cc1)n2c(nnc2SCC(=O)Nc3cccc4c3cccc4)COc5ccccc5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H24N4O3S
All Atoms:36
Heavy Atoms:36
Chiral Atoms:0
ZAP Information [?]
Total:12.8458
Area:752.22
Solvation:-5.95966
Coulombic:-49.3658
Bond Count [?]
All:40
Single:26
Double:14
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:496.581
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:6.96
LogP (Chemaxon):4.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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