Chemical ID: 4862437

CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)c2ccc(c(c2)Cl)OC)c3cccc(c3)[N+](=O)[O-]
Chemical ID:
4862437
Name [?]:
4-(3-chloro-4-methoxy-benzoyl)-1-(3-diethylaminopropyl)-3-hydroxy-5-(3-nitrophenyl)-5H-pyrrol-2-one
SMILES [?]:
CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)c2ccc(c(c2)Cl)OC)c3cccc(c3)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H28ClN3O6
All Atoms:35
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:6.99283
Area:736.922
Solvation:-11.4302
Coulombic:-66.3282
Bond Count [?]
All:37
Single:27
Double:10
Rotors:11
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:501.959
H-Bond Donors:1
H-Bond Acceptors:9
XLogP:4.56
LogP (Chemaxon):0.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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