Chemical ID: 6191707

Cc1ccc(cc1)c2c(sc(n2)C)C
Chemical ID:
6191707
Name [?]:
2,5-dimethyl-4-(p-tolyl)thiazole
SMILES [?]:
Cc1ccc(cc1)c2c(sc(n2)C)C
InChi [?]:
InChI=1/C12H13NS/c1-8-4-6-11(7-5-8)12-9(2)14-10(3)13-12/h4-7H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,14,13,3,7,4,6,2,9,11,5,8,12,10/E:(4,5)(6,7)/rA:14nCCCCCCCCCSCNCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s9;s10;s8d11;s11;s9;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H13NS
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:8.49403
Area:380.433
Solvation:-1.0168
Coulombic:-7.01905
Bond Count [?]
All:15
Single:10
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:203.304
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.0
LogP (Chemaxon):3.23

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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