Chemical ID: 6350593

CCOc1ccccc1C(=O)Nc2nc(c(s2)C)C
Chemical ID:
6350593
Name [?]:
N-(4,5-dimethylthiazol-2-yl)-2-ethoxy-benzamide
SMILES [?]:
CCOc1ccccc1C(=O)Nc2nc(c(s2)C)C
InChi [?]:
InChI=1/C14H16N2O2S/c1-4-18-12-8-6-5-7-11(12)13(17)16-14-15-9(2)10(3)19-14/h5-8H,4H2,1-3H3,(H,15,16,17)
InChi Info:
AuxInfo=1/1/N:1,19,18,2,7,6,8,5,15,16,9,4,10,13,14,12,11,3,17/rA:19nCCOCCCCCCCONCNCCSCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;d10;s10;s12;d13;s14;d15;s13s16;s16;s15;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H16N2O2S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.43818
Area:476.516
Solvation:-4.47472
Coulombic:-32.564
Bond Count [?]
All:20
Single:14
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:276.355
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.3
LogP (Chemaxon):2.62

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Descriptor Annotations

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