Chemical ID: 6756446

Cc1ccccc1C(=O)Nc2c(c3c(s2)CCC3)C(=O)N4CC[NH+](CC4)C
Chemical ID:
6756446
Name [?]:
2-methyl-N-[8-[(4-methyl-2,3,5,6-tetrahydropyrazin-1-yl)carbonyl]-6-thiabicyclo[3.3.0]octa-7,9-dien-7-yl]-benzamide
SMILES [?]:
Cc1ccccc1C(=O)Nc2c(c3c(s2)CCC3)C(=O)N4CC[NH+](CC4)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H26N3O2S+
All Atoms:53
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:-20.5231
Area:583.301
Solvation:-35.1056
Coulombic:-7.17002
Bond Count [?]
All:30
Single:23
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:384.516
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.2
LogP (Chemaxon):3.19

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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