Chemical ID: 7140053

c1cc(ccc1C=C2C(=O)NC(=Nc3ccc(c(c3)Cl)Cl)S2)O
Chemical ID:
7140053
Name [?]:
2-(3,4-dichlorophenyl)imino-5-[(4-hydroxyphenyl)methylene]thiazolidin-4-one
SMILES [?]:
c1cc(ccc1C=C2C(=O)NC(=Nc3ccc(c(c3)Cl)Cl)S2)O
InChi [?]:
InChI=1/C16H10Cl2N2O2S/c17-12-6-3-10(8-13(12)18)19-16-20-15(22)14(23-16)7-9-1-4-11(21)5-2-9/h1-8,21H,(H,19,20,22)
InChi Info:
AuxInfo=1/1/N:1,5,15,2,4,16,7,19,6,14,3,17,18,8,9,12,21,20,13,11,23,10,22/E:(1,2)(4,5)/rA:23nCCCCCCCCCONCNCCCCCCClClSO/rB:s1;d2;s3;d4;d1s5;s6;w7;s8;d9;s9;s11;w12;s13;s14;d15;s16;d17;d14s18;s18;s17;s8s12;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H10Cl2N2O2S
All Atoms:33
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.7254
Area:544.479
Solvation:-2.88658
Coulombic:-45.5882
Bond Count [?]
All:25
Single:16
Double:9
Rotors:2
Chiral:2
Rigid Segments:3
Chemical Properties
Molecular Weight:365.234
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.93
LogP (Chemaxon):5.1

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Descriptor Annotations

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