Chemical ID: 4403583

CCN1C(=C(C(NC1=O)c2ccc(cc2)Cl)C(=O)OC)C
Chemical ID:
4403583
Name [?]:
methyl 4-(4-chlorophenyl)-1-ethyl-6-methyl-2-oxo-3,4-dihydropyrimidine-5-carboxylate
SMILES [?]:
CCN1C(=C(C(NC1=O)c2ccc(cc2)Cl)C(=O)OC)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H17ClN2O3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:9.69386
Area:475.125
Solvation:-2.18426
Coulombic:-50.7715
Bond Count [?]
All:22
Single:16
Double:6
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:308.76
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.1
LogP (Chemaxon):1.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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