Chemical ID: 6360985

Cc1c(nc(s1)NC(=O)COc2ccc3ccccc3c2)c4ccccc4
Chemical ID:
6360985
Name [?]:
N-(5-methyl-4-phenyl-thiazol-2-yl)-2-(2-naphthyloxy)acetamide
SMILES [?]:
Cc1c(nc(s1)NC(=O)COc2ccc3ccccc3c2)c4ccccc4
InChi [?]:
InChI=1/C22H18N2O2S/c1-15-21(17-8-3-2-4-9-17)24-22(27-15)23-20(25)14-26-19-12-11-16-7-5-6-10-18(16)13-19/h2-13H,14H2,1H3,(H,23,24,25)
InChi Info:
AuxInfo=1/1/N:1,25,24,26,17,18,16,23,27,19,14,13,21,10,2,15,22,20,12,8,3,5,7,4,9,11,6/E:(3,4)(8,9)/rA:27nCCCNCSNCOCOCCCCCCCCCCCCCCCC/rB:s1;d2;s3;d4;s2s5;s5;s7;d8;s8;s10;s11;s12;d13;s14;s15;d16;s17;d18;d15s19;d12s20;s3;s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H18N2O2S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.3737
Area:599.297
Solvation:-4.60878
Coulombic:-36.3635
Bond Count [?]
All:30
Single:19
Double:11
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:374.457
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.63
LogP (Chemaxon):5.22

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