Chemical ID: 6182971

c1ccc(cc1)C(=O)CSc2nnc(n2c3ccccc3)CNC(=O)c4ccccc4
Chemical ID:
6182971
Name [?]:
N-[(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide
SMILES [?]:
c1ccc(cc1)C(=O)CSc2nnc(n2c3ccccc3)CNC(=O)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H20N4O2S
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:13.3048
Area:683.937
Solvation:-3.79364
Coulombic:-45.1273
Bond Count [?]
All:34
Single:21
Double:13
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:428.507
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.85
LogP (Chemaxon):3.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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