Chemical ID: 4518829

C1C(NC(=O)NC1=O)C(=O)O
Chemical ID:
4518829
Name [?]:
2,6-dioxohexahydropyrimidine-4-carboxylic acid
SMILES [?]:
C1C(NC(=O)NC1=O)C(=O)O
InChi [?]:
InChI=1/C5H6N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h2H,1H2,(H,9,10)(H2,6,7,8,11)
InChi Info:
AuxInfo=1/1/N:1,2,7,9,4,3,6,8,10,11,5/E:(9,10)/rA:11cCCNCONCOCOO/rB:s1;s2;s3;d4;s4;s1s6;d7;s2;d9;s9;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H6N2O4
All Atoms:11
Heavy Atoms:11
Chiral Atoms:1
ZAP Information [?]
Total:4.06113
Area:299.043
Solvation:-3.41494
Coulombic:-66.4586
Bond Count [?]
All:11
Single:8
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:158.112
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:-1.67
LogP (Chemaxon):-1.43

Name Annotations

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Descriptor Annotations

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