Chemical ID: 6498307

c1cc(ccc1C=C2C(=O)NC(=O)N2)C=C3C(=O)NC(=O)N3
Chemical ID:
6498307
Name [?]:
5-[[4-[(2,5-dioxoimidazolidin-4-ylidene)methyl]phenyl]methylene]imidazolidine-2,4-dione
SMILES [?]:
c1cc(ccc1C=C2C(=O)NC(=O)N2)C=C3C(=O)NC(=O)N3
InChi [?]:
InChI=1/C14H10N4O4/c19-11-9(15-13(21)17-11)5-7-1-2-8(4-3-7)6-10-12(20)18-14(22)16-10/h1-6H,(H2,15,17,19,21)(H2,16,18,20,22)
InChi Info:
AuxInfo=1/1/N:1,2,5,4,7,15,6,3,8,16,9,17,12,20,14,22,11,19,10,18,13,21/E:(1,2,3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)/gE:(1,2)/rA:22nCCCCCCCCCONCONCCCONCON/rB:s1;d2;s3;d4;d1s5;s6;w7;s8;d9;s9;s11;d12;s8s12;s3;w15;s16;d17;s17;s19;d20;s16s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H10N4O4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.6408
Area:465.885
Solvation:-4.00632
Coulombic:-86.5016
Bond Count [?]
All:24
Single:15
Double:9
Rotors:2
Chiral:2
Rigid Segments:3
Chemical Properties
Molecular Weight:298.254
H-Bond Donors:4
H-Bond Acceptors:8
XLogP:0.13
LogP (Chemaxon):-0.38

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Descriptor Annotations

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