Chemical ID: 4395134

CCC1(C(=O)N(C(=O)N(C1=O)COC)COC)c2ccccc2
Chemical ID:
4395134
Name [?]:
5-ethyl-1,3-bis(methoxymethyl)-5-phenyl-hexahydropyrimidine-2,4,6-trione
SMILES [?]:
CCC1(C(=O)N(C(=O)N(C1=O)COC)COC)c2ccccc2
InChi [?]:
InChI=1/C16H20N2O5/c1-4-16(12-8-6-5-7-9-12)13(19)17(10-22-2)15(21)18(11-23-3)14(16)20/h5-9H,4,10-11H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,14,17,2,21,20,22,19,23,12,15,18,10,4,7,3,9,6,11,5,8,13,16/E:(2,3)(6,7)(8,9)(10,11)(13,14)(17,18)(19,20)(22,23)/rA:23nCCCCONCONCOCOCCOCCCCCCC/rB:s1;s2;s3;d4;s4;s6;d7;s7;s3s9;d10;s9;s12;s13;s6;s15;s16;s3;s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H20N2O5
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:6.75012
Area:474.985
Solvation:-5.12449
Coulombic:-59.9435
Bond Count [?]
All:24
Single:18
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:320.34
H-Bond Donors:0
H-Bond Acceptors:7
XLogP:1.5
LogP (Chemaxon):2.46

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