Chemical ID: 7356585

CCC(C)Nc1nc(c(s1)C)c2ccc(cc2)C
Chemical ID:
7356585
Name [?]:
5-methyl-4-(p-tolyl)-N-sec-butyl-thiazol-2-amine
SMILES [?]:
CCC(C)Nc1nc(c(s1)C)c2ccc(cc2)C
InChi [?]:
InChI=1/C15H20N2S/c1-5-11(3)16-15-17-14(12(4)18-15)13-8-6-10(2)7-9-13/h6-9,11H,5H2,1-4H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,18,4,11,2,14,16,13,17,15,3,9,12,8,6,5,7,10/E:(6,7)(8,9)/rA:18cCCCCNCNCCSCCCCCCCC/rB:s1;s2;s3;s3;s5;d6;s7;d8;s6s9;s9;s8;s12;d13;s14;d15;d12s16;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H20N2S
All Atoms:38
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:10.6075
Area:469.25
Solvation:-1.12376
Coulombic:-20.4196
Bond Count [?]
All:19
Single:14
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:260.399
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.03
LogP (Chemaxon):4.65

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Descriptor Annotations

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