Chemical ID: 5573490

CN1C(=Cc2ccncc2)C(=O)NC1=O
Chemical ID:
5573490
Name [?]:
1-methyl-5-(4-pyridylmethylene)imidazolidine-2,4-dione
SMILES [?]:
CN1C(=Cc2ccncc2)C(=O)NC1=O
InChi [?]:
InChI=1/C10H9N3O2/c1-13-8(9(14)12-10(13)15)6-7-2-4-11-5-3-7/h2-6H,1H3,(H,12,14,15)
InChi Info:
AuxInfo=1/1/N:1,6,10,7,9,4,5,3,11,14,8,13,2,12,15/E:(2,3)(4,5)/rA:15nCNCCCCCNCCCONCO/rB:s1;s2;w3;s4;s5;d6;s7;d8;d5s9;s3;d11;s11;s2s13;d14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H9N3O2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.2012
Area:356.954
Solvation:-2.72266
Coulombic:-43.3141
Bond Count [?]
All:16
Single:10
Double:6
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:203.197
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:-0.03
LogP (Chemaxon):-0.23

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Descriptor Annotations

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