Chemical ID: 5933298

CCCCN1C(=C(C(NC1=O)c2ccc(cc2)NC(=O)CC)C(=O)OCC)C
Chemical ID:
5933298
Name [?]:
ethyl 1-butyl-6-methyl-2-oxo-4-(4-propanoylaminophenyl)-3,4-dihydropyrimidine-5-carboxylate
SMILES [?]:
CCCCN1C(=C(C(NC1=O)c2ccc(cc2)NC(=O)CC)C(=O)OCC)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H29N3O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:11.9159
Area:615.043
Solvation:-3.46012
Coulombic:-69.8177
Bond Count [?]
All:29
Single:22
Double:7
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:387.473
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:2.34
LogP (Chemaxon):1.97

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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