Chemical ID: 5535419

CC(C(=O)N)Sc1nnc(n1c2ccccc2)C3CC3
Chemical ID:
5535419
Name [?]:
2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide
SMILES [?]:
CC(C(=O)N)Sc1nnc(n1c2ccccc2)C3CC3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H16N4OS
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:9.64327
Area:481.644
Solvation:-2.39782
Coulombic:-37.8275
Bond Count [?]
All:22
Single:16
Double:6
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:288.369
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:2.8
LogP (Chemaxon):1.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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