Chemical ID: 3850849

CC(C)(C)c1ccc(cc1)c2nnc(n2CCCOC)SCC(=O)N
Chemical ID:
3850849
Name [?]:
2-[[4-(3-methoxypropyl)-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
SMILES [?]:
CC(C)(C)c1ccc(cc1)c2nnc(n2CCCOC)SCC(=O)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H26N4O2S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.7492
Area:603.652
Solvation:-4.34214
Coulombic:-46.0939
Bond Count [?]
All:26
Single:20
Double:6
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:362.491
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:4.43
LogP (Chemaxon):2.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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