Chemical ID: 3944462

COc1ccc(cc1)N(CC(=O)NCc2ccc(cc2)F)C(=O)c3csnn3
Chemical ID:
3944462
Name [?]:
N-[(4-fluorophenyl)methylcarbamoylmethyl]-N-(4-methoxyphenyl)-thiadiazole-4-carboxamide
SMILES [?]:
COc1ccc(cc1)N(CC(=O)NCc2ccc(cc2)F)C(=O)c3csnn3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H17FN4O3S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.38618
Area:596.274
Solvation:-5.52068
Coulombic:-51.4225
Bond Count [?]
All:30
Single:20
Double:10
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:400.428
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.88
LogP (Chemaxon):1.86

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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