Chemical ID: 5945721

CCCCCN(Cc1nc(cs1)C(=O)OCC)C(=O)c2ccc(cc2)Br
Chemical ID:
5945721
Name [?]:
ethyl 2-[[(4-bromobenzoyl)-pentyl-amino]methyl]thiazole-4-carboxylate
SMILES [?]:
CCCCCN(Cc1nc(cs1)C(=O)OCC)C(=O)c2ccc(cc2)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H23BrN2O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:12.7302
Area:634.825
Solvation:-3.14038
Coulombic:-45.3737
Bond Count [?]
All:27
Single:20
Double:7
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:439.368
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.88
LogP (Chemaxon):4.26

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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