Chemical ID: 7365866

CCc1ccc(cc1)c2c(sc(n2)NC(C)(C)C)C
Chemical ID:
7365866
Name [?]:
4-(4-ethylphenyl)-5-methyl-N-tert-butyl-thiazol-2-amine
SMILES [?]:
CCc1ccc(cc1)c2c(sc(n2)NC(C)(C)C)C
InChi [?]:
InChI=1/C16H22N2S/c1-6-12-7-9-13(10-8-12)14-11(2)19-15(17-14)18-16(3,4)5/h7-10H,6H2,1-5H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,19,16,17,18,2,4,8,5,7,10,3,6,9,12,15,13,14,11/E:(3,4,5)(7,8)(9,10)/rA:19nCCCCCCCCCCSCNNCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s10;s11;s9d12;s12;s14;s15;s15;s15;s10;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H22N2S
All Atoms:41
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:10.8121
Area:477.68
Solvation:-1.1299
Coulombic:-20.469
Bond Count [?]
All:20
Single:15
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:274.425
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.56
LogP (Chemaxon):4.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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