Chemical ID: 6615203

c1ccc(c(c1)C=NNc2nc(cs2)c3ccc(cc3)F)F
Chemical ID:
6615203
Name [?]:
4-(4-fluorophenyl)-N-[(2-fluorophenyl)methyleneamino]thiazol-2-amine
SMILES [?]:
c1ccc(c(c1)C=NNc2nc(cs2)c3ccc(cc3)F)F
InChi [?]:
InChI=1/C16H11F2N3S/c17-13-7-5-11(6-8-13)15-10-22-16(20-15)21-19-9-12-3-1-2-4-14(12)18/h1-10H,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,16,20,17,19,7,13,15,5,18,4,12,10,21,22,8,11,9,14/E:(5,6)(7,8)/rA:22nCCCCCCCNNCNCCSCCCCCCFF/rB:s1;d2;s3;d4;d1s5;s5;w7;s8;s9;d10;s11;d12;s10s13;s12;s15;d16;s17;d18;d15s19;s18;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H11F2N3S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.96662
Area:499.162
Solvation:-3.51244
Coulombic:-25.6914
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:315.342
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.5
LogP (Chemaxon):5.43

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Descriptor Annotations

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