Chemical ID: 4098954

CCOC(=O)c1c(c2c(s1)ncn(c2=O)CC(=O)NCc3ccco3)C
Chemical ID:
4098954
Name [?]:
ethyl 3-(2-furylmethylcarbamoylmethyl)-9-methyl-2-oxo-7-thia-3,5-diazabicyclo[4.3.0]nona-4,8,10-triene-8-carboxylate
SMILES [?]:
CCOC(=O)c1c(c2c(s1)ncn(c2=O)CC(=O)NCc3ccco3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H17N3O5S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.6225
Area:593.826
Solvation:-5.22315
Coulombic:-67.4783
Bond Count [?]
All:28
Single:20
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:375.4
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:-0.14
LogP (Chemaxon):0.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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