Chemical ID: 4866952

CCCCOc1cccc(c1)C2C(=C(C(=O)N2CCCN(C)C)O)C(=O)c3ccc4c(c3)OCCO4
Chemical ID:
4866952
Name [?]:
5-(3-butoxyphenyl)-1-(3-dimethylaminopropyl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-ylcarbonyl)-3-hydroxy-5H-pyrrol-2-one
SMILES [?]:
CCCCOc1cccc(c1)C2C(=C(C(=O)N2CCCN(C)C)O)C(=O)c3ccc4c(c3)OCCO4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H34N2O6
All Atoms:36
Heavy Atoms:36
Chiral Atoms:1
ZAP Information [?]
Total:12.3433
Area:774.837
Solvation:-7.02762
Coulombic:-71.5333
Bond Count [?]
All:39
Single:30
Double:9
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:494.579
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:4.29
LogP (Chemaxon):-0.36

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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