Chemical ID: 6216260

c1ccc(c(c1)C(=O)Nc2nc(cs2)c3ccc(cc3)Cl)Cl
Chemical ID:
6216260
Name [?]:
2-chloro-N-[4-(4-chlorophenyl)thiazol-2-yl]-benzamide
SMILES [?]:
c1ccc(c(c1)C(=O)Nc2nc(cs2)c3ccc(cc3)Cl)Cl
InChi [?]:
InChI=1/C16H10Cl2N2OS/c17-11-7-5-10(6-8-11)14-9-22-16(19-14)20-15(21)12-3-1-2-4-13(12)18/h1-9H,(H,19,20,21)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,16,20,17,19,13,15,18,5,4,12,7,10,21,22,11,9,8,14/E:(5,6)(7,8)/rA:22nCCCCCCCONCNCCSCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;d10;s11;d12;s10s13;s12;s15;d16;s17;d18;d15s19;s18;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H10Cl2N2OS
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.8508
Area:536.063
Solvation:-2.55075
Coulombic:-29.655
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:349.235
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.07
LogP (Chemaxon):5.48

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