Chemical ID: 5687846

CCOc1ccccc1NC(=O)c2cc(ccc2N3CCN(CC3)Cc4ccccc4)N(=O)=O
Chemical ID:
5687846
Name [?]:
2-(4-benzylpiperazin-1-yl)-N-(2-ethoxyphenyl)-5-nitro-benzamide
SMILES [?]:
CCOc1ccccc1NC(=O)c2cc(ccc2N3CCN(CC3)Cc4ccccc4)N(=O)=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H28N4O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:7.92143
Area:709.891
Solvation:-9.82585
Coulombic:-52.0259
Bond Count [?]
All:37
Single:25
Double:12
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:460.525
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:4.78
LogP (Chemaxon):4.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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