Chemical ID: 6047405

CCN(CC)C(=O)c1ccc(cc1)C(c2cccc(c2)OC)N3CC(N(CC3C)CC=C)C
Chemical ID:
6047405
Name [?]:
4-[(4-allyl-2,5-dimethyl-piperazin-1-yl)-(3-methoxyphenyl)-methyl]-N,N-diethyl-benzamide
SMILES [?]:
CCN(CC)C(=O)c1ccc(cc1)C(c2cccc(c2)OC)N3CC(N(CC3C)CC=C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H39N3O2
All Atoms:33
Heavy Atoms:33
Chiral Atoms:5
ZAP Information [?]
Total:13.5438
Area:701.75
Solvation:-3.99997
Coulombic:-38.8608
Bond Count [?]
All:35
Single:27
Double:8
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:449.628
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.83
LogP (Chemaxon):4.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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