Chemical ID: 7536805

COc1ccc(cc1)C(=O)NCCc2nnc(n2CC=C)SCC(=O)Nc3ccccc3F
Chemical ID:
7536805
Name [?]:
N-[2-[4-allyl-5-[(2-fluorophenyl)carbamoylmethylsulfanyl]-1,2,4-triazol-3-yl]ethyl]-4-methoxy-benzamide
SMILES [?]:
COc1ccc(cc1)C(=O)NCCc2nnc(n2CC=C)SCC(=O)Nc3ccccc3F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H24FN5O3S
All Atoms:57
Heavy Atoms:33
Chiral Atoms:None
ZAP Information [?]
Total:12.1988
Area:725.871
Solvation:-5.94801
Coulombic:-66.4994
Bond Count [?]
All:35
Single:24
Double:11
Rotors:13
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.55
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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