Chemical ID: 3996786

CCOC(=O)c1c(c2c(=O)[nH]c(nc2s1)CN3CCC(CC3)C)C
Chemical ID:
3996786
Name [?]:
ethyl 9-methyl-4-[(4-methyl-1-piperidyl)methyl]-2-oxo-7-thia-3,5-diazabicyclo[4.3.0]nona-4,8,10-triene-8-carboxylate
SMILES [?]:
CCOC(=O)c1c(c2c(=O)[nH]c(nc2s1)CN3CCC(CC3)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H23N3O3S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.902
Area:554.041
Solvation:-2.94901
Coulombic:-50.6859
Bond Count [?]
All:26
Single:21
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:349.449
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.27
LogP (Chemaxon):1.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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