Chemical ID: 4323094

Cc1ccc(cc1)C(=O)Nc2c(c3c(s2)CCCCC3)C(=O)N4CCN(CC4)Cc5ccccc5
Chemical ID:
4323094
Name [?]:
N-[10-(4-benzylpiperazin-1-yl)carbonyl-8-thiabicyclo[5.3.0]deca-9,11-dien-9-yl]-4-methyl-benzamide
SMILES [?]:
Cc1ccc(cc1)C(=O)Nc2c(c3c(s2)CCCCC3)C(=O)N4CCN(CC4)Cc5ccccc5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C29H33N3O2S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:14.5827
Area:725.069
Solvation:-3.544
Coulombic:-46.2977
Bond Count [?]
All:39
Single:29
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:487.657
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.05
LogP (Chemaxon):5.76

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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