Chemical ID: 6216918

CCCCC(=O)Nc1nc(cs1)c2cc(ccc2Cl)Cl
Chemical ID:
6216918
Name [?]:
N-[4-(2,5-dichlorophenyl)thiazol-2-yl]pentanamide
SMILES [?]:
CCCCC(=O)Nc1nc(cs1)c2cc(ccc2Cl)Cl
InChi [?]:
InChI=1/C14H14Cl2N2OS/c1-2-3-4-13(19)18-14-17-12(8-20-14)10-7-9(15)5-6-11(10)16/h5-8H,2-4H2,1H3,(H,17,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,16,17,14,11,15,13,18,10,5,8,20,19,9,7,6,12/rA:20nCCCCCONCNCCSCCCCCCClCl/rB:s1;s2;s3;s4;d5;s5;s7;d8;s9;d10;s8s11;s10;s13;d14;s15;d16;d13s17;s18;s15;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H14Cl2N2OS
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:10.5823
Area:522.473
Solvation:-2.47954
Coulombic:-27.1683
Bond Count [?]
All:21
Single:15
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:329.245
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.75
LogP (Chemaxon):5.17

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