Chemical ID: 5628053

CCCCCC1CCC(CC1)C(=O)Nc2nnc(s2)c3ccc(cc3)Br
Chemical ID:
5628053
Name [?]:
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-4-pentyl-cyclohexane-1-carboxamide
SMILES [?]:
CCCCCC1CCC(CC1)C(=O)Nc2nnc(s2)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H26BrN3OS
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:13.5294
Area:644.863
Solvation:-2.59222
Coulombic:-27.9895
Bond Count [?]
All:28
Single:22
Double:6
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:436.41
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:7.96
LogP (Chemaxon):6.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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