Chemical ID: 3849962

CC(C(=O)Nc1ccccc1)Sc2nnc(n2c3ccccc3)COc4ccccc4OC
Chemical ID:
3849962
Name [?]:
2-[[5-[(2-methoxyphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide
SMILES [?]:
CC(C(=O)Nc1ccccc1)Sc2nnc(n2c3ccccc3)COc4ccccc4OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H24N4O3S
All Atoms:33
Heavy Atoms:33
Chiral Atoms:1
ZAP Information [?]
Total:11.2463
Area:709.091
Solvation:-6.48101
Coulombic:-49.2793
Bond Count [?]
All:36
Single:24
Double:12
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:460.549
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.72
LogP (Chemaxon):4.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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