Chemical ID: 4861831

CCOc1ccc(cc1)C2C(=C(C(=O)N2CCN(C)C)O)C(=O)c3ccc4c(c3)OCCO4
Chemical ID:
4861831
Name [?]:
1-(2-dimethylaminoethyl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-ylcarbonyl)-5-(4-ethoxyphenyl)-3-hydroxy-5H-pyrrol-2-one
SMILES [?]:
CCOc1ccc(cc1)C2C(=C(C(=O)N2CCN(C)C)O)C(=O)c3ccc4c(c3)OCCO4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H28N2O6
All Atoms:33
Heavy Atoms:33
Chiral Atoms:1
ZAP Information [?]
Total:10.181
Area:696.304
Solvation:-7.22658
Coulombic:-70.6592
Bond Count [?]
All:36
Single:27
Double:9
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:452.5
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:3.01
LogP (Chemaxon):-0.93

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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