Chemical ID: 5974771

CCCC(=O)N1CCN(CC1)C(=O)c2cc(n(c2C)c3ccccc3OC)c4ccc(cc4)Cl
Chemical ID:
5974771
Name [?]:
1-[4-[5-(4-chlorophenyl)-1-(2-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]butan-1-one
SMILES [?]:
CCCC(=O)N1CCN(CC1)C(=O)c2cc(n(c2C)c3ccccc3OC)c4ccc(cc4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H30ClN3O3
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:13.0278
Area:718.532
Solvation:-4.93545
Coulombic:-47.3882
Bond Count [?]
All:37
Single:27
Double:10
Rotors:8
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:479.998
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:5.13
LogP (Chemaxon):3.71

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Experimental Annotations

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Descriptor Annotations

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