Chemical ID: 5585434

CC(C)N(c1ccccc1)C(=O)CSc2nnc(n2C)c3ccccc3
Chemical ID:
5585434
Name [?]:
N-isopropyl-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-acetamide
SMILES [?]:
CC(C)N(c1ccccc1)C(=O)CSc2nnc(n2C)c3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H22N4OS
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.9208
Area:584.252
Solvation:-2.68545
Coulombic:-30.8331
Bond Count [?]
All:28
Single:19
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:366.481
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.56
LogP (Chemaxon):3.82

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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