Chemical ID: 5939931

CCNc1nc(cs1)c2ccc(cc2)NC(=O)c3ccc(cc3)OC
Chemical ID:
5939931
Name [?]:
N-[4-(2-ethylaminothiazol-4-yl)phenyl]-4-methoxy-benzamide
SMILES [?]:
CCNc1nc(cs1)c2ccc(cc2)NC(=O)c3ccc(cc3)OC
InChi [?]:
InChI=1/C19H19N3O2S/c1-3-20-19-22-17(12-25-19)13-4-8-15(9-5-13)21-18(23)14-6-10-16(24-2)11-7-14/h4-12H,3H2,1-2H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,25,2,10,14,19,23,11,13,20,22,7,9,18,12,21,6,16,4,3,15,5,17,24,8/E:(4,5)(6,7)(8,9)(10,11)/rA:25nCCNCNCCSCCCCCCNCOCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;s4s7;s6;s9;d10;s11;d12;d9s13;s12;s15;d16;s16;s18;d19;s20;d21;d18s22;s21;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H19N3O2S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.8883
Area:587.141
Solvation:-3.79025
Coulombic:-47.5318
Bond Count [?]
All:27
Single:18
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:353.439
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.81
LogP (Chemaxon):4.11

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