Chemical ID: 5300543

CCn1c(nnc1SCC(=O)Nc2c(cc(cc2C)C)C)c3ccccc3OC
Chemical ID:
5300543
Name [?]:
2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)-acetamide
SMILES [?]:
CCn1c(nnc1SCC(=O)Nc2c(cc(cc2C)C)C)c3ccccc3OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H26N4O2S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:11.5679
Area:646.607
Solvation:-4.5973
Coulombic:-40.1358
Bond Count [?]
All:31
Single:22
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:410.534
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.76
LogP (Chemaxon):3.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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