Chemical ID: 5939977

CCNc1nc(cs1)c2cccc(c2)NC(=O)c3cccc(c3)OC
Chemical ID:
5939977
Name [?]:
N-[3-(2-ethylaminothiazol-4-yl)phenyl]-3-methoxy-benzamide
SMILES [?]:
CCNc1nc(cs1)c2cccc(c2)NC(=O)c3cccc(c3)OC
InChi [?]:
InChI=1/C19H19N3O2S/c1-3-20-19-22-17(12-25-19)13-6-4-8-15(10-13)21-18(23)14-7-5-9-16(11-14)24-2/h4-12H,3H2,1-2H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,25,2,11,20,10,19,12,21,14,23,7,9,18,13,22,6,16,4,3,15,5,17,24,8/rA:25nCCNCNCCSCCCCCCNCOCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;s4s7;s6;s9;d10;s11;d12;d9s13;s13;s15;d16;s16;s18;d19;s20;d21;d18s22;s22;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H19N3O2S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.3863
Area:582.401
Solvation:-4.17375
Coulombic:-47.1156
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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