Chemical ID: 6266946

Cc1c(nc(s1)NC(=O)CCOc2ccccc2)c3ccc(cc3)OC
Chemical ID:
6266946
Name [?]:
N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]-3-phenoxy-propanamide
SMILES [?]:
Cc1c(nc(s1)NC(=O)CCOc2ccccc2)c3ccc(cc3)OC
InChi [?]:
InChI=1/C20H20N2O3S/c1-14-19(15-8-10-16(24-2)11-9-15)22-20(26-14)21-18(23)12-13-25-17-6-4-3-5-7-17/h3-11H,12-13H2,1-2H3,(H,21,22,23)
InChi Info:
AuxInfo=1/1/N:1,26,16,15,17,14,18,20,24,21,23,10,11,2,19,22,13,8,3,5,7,4,9,25,12,6/E:(4,5)(6,7)(8,9)(10,11)/rA:26nCCCNCSNCOCCOCCCCCCCCCCCCOC/rB:s1;d2;s3;d4;s2s5;s5;s7;d8;s8;s10;s11;s12;s13;d14;s15;d16;d13s17;s3;s19;d20;s21;d22;d19s23;s22;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H20N2O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.433
Area:601.875
Solvation:-4.61385
Coulombic:-42.0315
Bond Count [?]
All:28
Single:19
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:368.45
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.43
LogP (Chemaxon):4.14

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Descriptor Annotations

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