Chemical ID: 5277969

C1CN(C(=O)N1)C(=O)CSC2=NCCS2
Chemical ID:
5277969
Name [?]:
1-[2-(4,5-dihydrothiazol-2-ylsulfanyl)acetyl]imidazolidin-2-one
SMILES [?]:
C1CN(C(=O)N1)C(=O)CSC2=NCCS2
InChi [?]:
InChI=1/C8H11N3O2S2/c12-6(11-3-1-9-7(11)13)5-15-8-10-2-4-14-8/h1-5H2,(H,9,13)
InChi Info:
AuxInfo=1/1/N:1,13,2,14,9,7,4,11,6,12,3,8,5,15,10/rA:15nCCNCONCOCSCNCCS/rB:s1;s2;s3;d4;s1s4;s3;d7;s7;s9;s10;d11;s12;s13;s11s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H11N3O2S2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.29678
Area:408.607
Solvation:-2.91839
Coulombic:-44.471
Bond Count [?]
All:16
Single:13
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:245.324
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:-0.5
LogP (Chemaxon):0.21

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Descriptor Annotations

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