Chemical ID: 5607479

Cc1ccc(c(c1)c2csc(n2)NC(=O)c3cccc(c3)OC)C
Chemical ID:
5607479
Name [?]:
N-[4-(2,5-dimethylphenyl)thiazol-2-yl]-3-methoxy-benzamide
SMILES [?]:
Cc1ccc(c(c1)c2csc(n2)NC(=O)c3cccc(c3)OC)C
InChi [?]:
InChI=1/C19H18N2O2S/c1-12-7-8-13(2)16(9-12)17-11-24-19(20-17)21-18(22)14-5-4-6-15(10-14)23-3/h4-11H,1-3H3,(H,20,21,22)
InChi Info:
AuxInfo=1/1/N:1,24,23,18,17,19,3,4,7,21,9,2,5,16,20,6,8,14,11,12,13,15,22,10/rA:24nCCCCCCCCCSCNNCOCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s9;s10;s8d11;s11;s13;d14;s14;s16;d17;s18;d19;d16s20;s20;s22;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2O2S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.0807
Area:549.568
Solvation:-3.65852
Coulombic:-35.6701
Bond Count [?]
All:26
Single:17
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:338.424
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.62
LogP (Chemaxon):5.13

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Descriptor Annotations

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