Chemical ID: 4491398

CC(=O)Nc1cccc(c1)c2csc(n2)Nc3ccc(cc3OC)OC
Chemical ID:
4491398
Name [?]:
N-[3-[2-(2,4-dimethoxyphenyl)aminothiazol-4-yl]phenyl]acetamide
SMILES [?]:
CC(=O)Nc1cccc(c1)c2csc(n2)Nc3ccc(cc3OC)OC
InChi [?]:
InChI=1/C19H19N3O3S/c1-12(23)20-14-6-4-5-13(9-14)17-11-26-19(22-17)21-16-8-7-15(24-2)10-18(16)25-3/h4-11H,1-3H3,(H,20,23)(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,26,24,7,8,6,19,18,10,21,12,2,9,5,20,17,11,22,14,4,16,15,3,25,23,13/rA:26nCCONCCCCCCCCSCNNCCCCCCOCOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s9;d11;s12;s13;s11d14;s14;s16;s17;d18;s19;d20;d17s21;s22;s23;s20;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H19N3O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.15847
Area:585.02
Solvation:-5.46703
Coulombic:-51.1832
Bond Count [?]
All:28
Single:19
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:369.439
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:3.15
LogP (Chemaxon):3.46

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