Chemical ID: 4101683

CC(C)(C)C1CCc2c(sc(n2)NC(=O)c3ccccc3Br)C1
Chemical ID:
4101683
Name [?]:
2-bromo-N-(6-tert-butyl-4,5,6,7-tetrahydrobenzothiazol-2-yl)-benzamide
SMILES [?]:
CC(C)(C)C1CCc2c(sc(n2)NC(=O)c3ccccc3Br)C1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H21BrN2OS
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:10.8294
Area:535.117
Solvation:-2.54856
Coulombic:-28.1835
Bond Count [?]
All:25
Single:19
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:393.342
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.12
LogP (Chemaxon):5.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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