Chemical ID: 6221899

CN1CCc2c(sc(c2C(=O)OC)NC(=O)CN3C(=O)CCC3=O)C1
Chemical ID:
6221899
Name [?]:
methyl 8-[2-(2,5-dioxopyrrolidin-1-yl)acetyl]amino-4-methyl-7-thia-4-azabicyclo[4.3.0]nona-8,10-diene-9-carboxylate
SMILES [?]:
CN1CCc2c(sc(c2C(=O)OC)NC(=O)CN3C(=O)CCC3=O)C1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H19N3O5S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:8.13774
Area:559.023
Solvation:-5.83783
Coulombic:-64.7485
Bond Count [?]
All:27
Single:21
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:365.405
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:-1.24
LogP (Chemaxon):-0.34

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Experimental Annotations

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Descriptor Annotations

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