Chemical ID: 4324234

CC(=O)Nc1ncc(s1)Cc2ccc(cc2)OC
Chemical ID:
4324234
Name [?]:
N-[5-[(4-methoxyphenyl)methyl]thiazol-2-yl]acetamide
SMILES [?]:
CC(=O)Nc1ncc(s1)Cc2ccc(cc2)OC
InChi [?]:
InChI=1/C13H14N2O2S/c1-9(16)15-13-14-8-12(18-13)7-10-3-5-11(17-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,14,15,16)
InChi Info:
AuxInfo=1/1/N:1,18,12,16,13,15,10,7,2,11,14,8,5,6,4,3,17,9/E:(3,4)(5,6)/rA:18nCCONCNCCSCCCCCCCOC/rB:s1;d2;s2;s4;d5;s6;d7;s5s8;s8;s10;s11;d12;s13;d14;d11s15;s14;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H14N2O2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.98959
Area:458.764
Solvation:-4.47951
Coulombic:-31.3132
Bond Count [?]
All:19
Single:13
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:262.329
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.14
LogP (Chemaxon):2.06

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Descriptor Annotations

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