Chemical ID: 6607517

CCOC(=O)c1c(c2c(=O)[nH]c(nc2s1)CN3CCCC3)C
Chemical ID:
6607517
Name [?]:
ethyl 9-methyl-2-oxo-4-(pyrrolidin-1-ylmethyl)-7-thia-3,5-diazabicyclo[4.3.0]nona-4,8,10-triene-8-carboxylate
SMILES [?]:
CCOC(=O)c1c(c2c(=O)[nH]c(nc2s1)CN3CCCC3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H19N3O3S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.9085
Area:512.274
Solvation:-2.89836
Coulombic:-50.2742
Bond Count [?]
All:24
Single:19
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:321.396
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:0.41
LogP (Chemaxon):1.16

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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