Chemical ID: 3845747

Cc1ccc(cc1)NCc2nnc(n2c3ccc(cc3)OC)SCc4ccccc4
Chemical ID:
3845747
Name [?]:
N-[[5-benzylsulfanyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-4-methyl-aniline
SMILES [?]:
Cc1ccc(cc1)NCc2nnc(n2c3ccc(cc3)OC)SCc4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H24N4OS
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:13.2731
Area:674.336
Solvation:-3.58526
Coulombic:-34.0734
Bond Count [?]
All:33
Single:22
Double:11
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:416.54
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.83
LogP (Chemaxon):5.15

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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