Chemical ID: 4751275

Cc1ccc(cc1Cl)c2c(sc(n2)NC(=O)c3ccc(cc3)OC)C
Chemical ID:
4751275
Name [?]:
N-[4-(3-chloro-4-methyl-phenyl)-5-methyl-thiazol-2-yl]-4-methoxy-benzamide
SMILES [?]:
Cc1ccc(cc1Cl)c2c(sc(n2)NC(=O)c3ccc(cc3)OC)C
InChi [?]:
InChI=1/C19H17ClN2O2S/c1-11-4-5-14(10-16(11)20)17-12(2)25-19(21-17)22-18(23)13-6-8-15(24-3)9-7-13/h4-10H,1-3H3,(H,21,22,23)
InChi Info:
AuxInfo=1/1/N:1,25,24,3,4,18,22,19,21,6,2,10,17,5,20,7,9,15,12,8,13,14,16,23,11/E:(6,7)(8,9)/rA:25nCCCCCCCClCCSCNNCOCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;d9;s10;s11;s9d12;s12;s14;d15;s15;s17;d18;s19;d20;d17s21;s20;s23;s10;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17ClN2O2S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.1159
Area:580.734
Solvation:-3.40248
Coulombic:-36.3131
Bond Count [?]
All:27
Single:18
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:372.869
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.44
LogP (Chemaxon):5.17

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