Chemical ID: 4839595

c1cc(oc1)C=C2C(=O)N=C(S2)Nc3ccc(cc3)O
Chemical ID:
4839595
Name [?]:
5-(2-furylmethylene)-2-(4-hydroxyphenyl)amino-thiazol-4-one
SMILES [?]:
c1cc(oc1)C=C2C(=O)N=C(S2)Nc3ccc(cc3)O
InChi [?]:
InChI=1/C14H10N2O3S/c17-10-5-3-9(4-6-10)15-14-16-13(18)12(20-14)8-11-2-1-7-19-11/h1-8,17H,(H,15,16,18)
InChi Info:
AuxInfo=1/1/N:1,2,15,19,16,18,5,6,14,17,3,7,8,11,13,10,20,9,4,12/E:(3,4)(5,6)/rA:20nCCCOCCCCONCSNCCCCCCO/rB:s1;d2;s3;d1s4;s3;w6;s7;d8;s8;d10;s7s11;s11;s13;s14;d15;s16;d17;d14s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H10N2O3S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.28051
Area:462.711
Solvation:-4.28727
Coulombic:-49.0712
Bond Count [?]
All:22
Single:14
Double:8
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:286.307
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.23
LogP (Chemaxon):2.87

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