Chemical ID: 3856066

CCN(CC)CCCN(c1nc(cs1)c2ccc(cc2)OC)C(=O)c3ccc(cc3)Br
Chemical ID:
3856066
Name [?]:
4-bromo-N-(3-diethylaminopropyl)-N-[4-(4-methoxyphenyl)thiazol-2-yl]-benzamide
SMILES [?]:
CCN(CC)CCCN(c1nc(cs1)c2ccc(cc2)OC)C(=O)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H28BrN3O2S
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:12.9158
Area:698.213
Solvation:-4.53955
Coulombic:-36.6824
Bond Count [?]
All:33
Single:24
Double:9
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:502.468
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:5.74
LogP (Chemaxon):5.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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