Chemical ID: 3888018

CCn1c(nnc1SCC(=O)Nc2ccc(cc2)N)Cc3ccccc3
Chemical ID:
3888018
Name [?]:
N-(4-aminophenyl)-2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
SMILES [?]:
CCn1c(nnc1SCC(=O)Nc2ccc(cc2)N)Cc3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H21N5OS
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.5843
Area:601.07
Solvation:-3.44247
Coulombic:-49.0586
Bond Count [?]
All:28
Single:19
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:367.469
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:3.53
LogP (Chemaxon):2.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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