Chemical ID: 5932957

CCN1C(=C(C(NC1=O)c2ccc(cc2)NC(=O)c3ccc(cc3)C(C)(C)C)C(=O)OCC)C
Chemical ID:
5932957
Name [?]:
ethyl 1-ethyl-6-methyl-2-oxo-4-[4-(4-tert-butylbenzoyl)aminophenyl]-3,4-dihydropyrimidine-5-carboxylate
SMILES [?]:
CCN1C(=C(C(NC1=O)c2ccc(cc2)NC(=O)c3ccc(cc3)C(C)(C)C)C(=O)OCC)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H33N3O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:14.2219
Area:704.009
Solvation:-3.37838
Coulombic:-73.0655
Bond Count [?]
All:36
Single:26
Double:10
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:463.569
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:4.69
LogP (Chemaxon):3.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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