Chemical ID: 4982490

CCOc1ccc(cc1c2csc(n2)N)C(C)C
Chemical ID:
4982490
Name [?]:
4-(2-ethoxy-5-isopropyl-phenyl)thiazol-2-amine
SMILES [?]:
CCOc1ccc(cc1c2csc(n2)N)C(C)C
InChi [?]:
InChI=1/C14H18N2OS/c1-4-17-13-6-5-10(9(2)3)7-11(13)12-8-18-14(15)16-12/h5-9H,4H2,1-3H3,(H2,15,16)
InChi Info:
AuxInfo=1/1/N:1,17,18,2,6,5,8,11,16,7,9,10,4,13,15,14,3,12/E:(2,3)/rA:18nCCOCCCCCCCCSCNNCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;d10;s11;s12;s10d13;s13;s7;s16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H18N2OS
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.51218
Area:459.209
Solvation:-2.96805
Coulombic:-30.1596
Bond Count [?]
All:19
Single:14
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:262.372
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:3.78
LogP (Chemaxon):3.89

Name Annotations

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Descriptor Annotations

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