Chemical ID: 3845458

CCc1cccc(c1NC(=O)CSc2nnc(n2Cc3ccccc3)Cc4ccccc4)CC
Chemical ID:
3845458
Name [?]:
2-[(4,5-dibenzyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-diethylphenyl)-acetamide
SMILES [?]:
CCc1cccc(c1NC(=O)CSc2nnc(n2Cc3ccccc3)Cc4ccccc4)CC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H30N4OS
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:14.6468
Area:732.656
Solvation:-3.66956
Coulombic:-35.6355
Bond Count [?]
All:37
Single:25
Double:12
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:470.63
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:7.43
LogP (Chemaxon):5.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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