Chemical ID: 6182649

CCOc1ccc(cc1)C=NN=c2[nH]c(cs2)c3ccc(cc3)OC
Chemical ID:
6182649
Name [?]:
N-[(4-ethoxyphenyl)methyleneamino]-4-(4-methoxyphenyl)-3H-thiazol-2-imine
SMILES [?]:
CCOc1ccc(cc1)C=NN=c2[nH]c(cs2)c3ccc(cc3)OC
InChi [?]:
InChI=1/C19H19N3O2S/c1-3-24-17-8-4-14(5-9-17)12-20-22-19-21-18(13-25-19)15-6-10-16(23-2)11-7-15/h4-13H,3H2,1-2H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,25,2,6,8,19,23,5,9,20,22,10,16,7,18,21,4,15,13,11,14,12,24,3,17/E:(4,5)(6,7)(8,9)(10,11)/rA:25nCCOCCCCCCCNNCNCCSCCCCCCOC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;w10;s11;w12;s13;s14;d15;s13s16;s15;s18;d19;s20;d21;d18s22;s21;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H19N3O2S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.3112
Area:586.137
Solvation:-4.34217
Coulombic:-31.9401
Bond Count [?]
All:27
Single:18
Double:9
Rotors:6
Chiral:2
Rigid Segments:6
Chemical Properties
Molecular Weight:353.439
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:6.06
LogP (Chemaxon):3.72

Name Annotations

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Descriptor Annotations

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