Chemical ID: 4119510

Cc1nc(cs1)c2cccc(c2)N
Chemical ID:
4119510
Name [?]:
3-(2-methylthiazol-4-yl)aniline
SMILES [?]:
Cc1nc(cs1)c2cccc(c2)N
InChi [?]:
InChI=1/C10H10N2S/c1-7-12-10(6-13-7)8-3-2-4-9(11)5-8/h2-6H,11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,9,8,10,12,5,2,7,11,4,13,3,6/rA:13nCCNCCSCCCCCCN/rB:s1;d2;s3;d4;s2s5;s4;s7;d8;s9;d10;d7s11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10N2S
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.71477
Area:362.481
Solvation:-1.34726
Coulombic:-22.5162
Bond Count [?]
All:14
Single:9
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:190.266
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.9
LogP (Chemaxon):1.98

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Experimental Annotations

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Descriptor Annotations

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