Chemical ID: 5616703

CC(=O)Nc1nc(cs1)c2ccc(c(c2)Cl)Cl
Chemical ID:
5616703
Name [?]:
N-[4-(3,4-dichlorophenyl)thiazol-2-yl]acetamide
SMILES [?]:
CC(=O)Nc1nc(cs1)c2ccc(c(c2)Cl)Cl
InChi [?]:
InChI=1/C11H8Cl2N2OS/c1-6(16)14-11-15-10(5-17-11)7-2-3-8(12)9(13)4-7/h2-5H,1H3,(H,14,15,16)
InChi Info:
AuxInfo=1/1/N:1,11,12,15,8,2,10,13,14,7,5,17,16,4,6,3,9/rA:17nCCONCNCCSCCCCCCClCl/rB:s1;d2;s2;s4;d5;s6;d7;s5s8;s7;s10;d11;s12;d13;d10s14;s14;s13;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H8Cl2N2OS
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.80925
Area:452.606
Solvation:-2.50589
Coulombic:-26.2468
Bond Count [?]
All:18
Single:12
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:287.165
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.36
LogP (Chemaxon):3.75

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Descriptor Annotations

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