Chemical ID: 6309753

CN1C(C(=O)NC1=N)C2(c3ccccc3NC2=O)O
Chemical ID:
6309753
Name [?]:
3-hydroxy-3-(2-imino-3-methyl-5-oxo-imidazolidin-4-yl)-indolin-2-one
SMILES [?]:
CN1C(C(=O)NC1=N)C2(c3ccccc3NC2=O)O
InChi [?]:
InChI=1/C12H12N4O3/c1-16-8(9(17)15-11(16)13)12(19)6-4-2-3-5-7(6)14-10(12)18/h2-5,8,19H,1H3,(H,14,18)(H2,13,15,17)
InChi Info:
AuxInfo=1/1/N:1,12,13,11,14,10,15,3,4,17,7,9,8,16,6,2,5,18,19/rA:19cCNCCONCNCCCCCCCNCOO/rB:s1;s2;s3;d4;s4;s2s6;w7;s3;s9;s10;d11;s12;d13;d10s14;s15;s9s16;d17;s9;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H12N4O3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:2
ZAP Information [?]
Total:6.0798
Area:393.069
Solvation:-3.74693
Coulombic:-78.2143
Bond Count [?]
All:21
Single:15
Double:6
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:260.249
H-Bond Donors:4
H-Bond Acceptors:7
XLogP:0.12
LogP (Chemaxon):0.14

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Descriptor Annotations

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