Chemical ID: 5394883

CCn1c(nnc1SCC(=O)Nc2ccc(cc2)OCC)CC(=O)Nc3ccccc3OC
Chemical ID:
5394883
Name [?]:
N-(4-ethoxyphenyl)-2-[[4-ethyl-5-[(2-methoxyphenyl)carbamoylmethyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
CCn1c(nnc1SCC(=O)Nc2ccc(cc2)OCC)CC(=O)Nc3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H27N5O4S
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:11.5885
Area:730.67
Solvation:-6.67831
Coulombic:-65.4317
Bond Count [?]
All:35
Single:25
Double:10
Rotors:13
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:469.558
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.05
LogP (Chemaxon):2.87

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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