Chemical ID: 6632316

CCC1(C(=O)NC(=NC1=O)O)CC
Chemical ID:
6632316
Name [?]:
5,5-diethyl-2-hydroxy-1H-pyrimidine-4,6-dione
SMILES [?]:
CCC1(C(=O)NC(=NC1=O)O)CC
InChi [?]:
InChI=1/C8H12N2O3/c1-3-8(4-2)5(11)9-7(13)10-6(8)12/h3-4H2,1-2H3,(H2,9,10,11,12,13)
InChi Info:
AuxInfo=1/1/N:1,13,2,12,4,9,7,3,6,8,5,10,11/E:(1,2)(3,4)(5,6)(9,10)(11,12)/rA:13nCCCCONCNCOOCC/rB:s1;s2;s3;d4;s4;s6;d7;s3s8;d9;s7;s3;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H12N2O3
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.08594
Area:329.25
Solvation:-2.14531
Coulombic:-52.6559
Bond Count [?]
All:13
Single:10
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:184.193
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:0.74
LogP (Chemaxon):1.23

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