Chemical ID: 5960217

CC1CN(CCN1C(=O)C(C)(C)CCl)c2nc(ns2)Cc3ccc(cc3)F
Chemical ID:
5960217
Name [?]:
3-chloro-1-[4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]-2,2-dimethyl-propan-1-one
SMILES [?]:
CC1CN(CCN1C(=O)C(C)(C)CCl)c2nc(ns2)Cc3ccc(cc3)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H24ClFN4OS
All Atoms:27
Heavy Atoms:27
Chiral Atoms:2
ZAP Information [?]
Total:11.3354
Area:599.014
Solvation:-3.63992
Coulombic:-38.0673
Bond Count [?]
All:29
Single:23
Double:6
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:410.937
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.56
LogP (Chemaxon):5.45

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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