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123310-03-2 | N-[4-(3,4-Dimethoxyphenyl)-1,3-thiazol-2-yl]guanidine
CAS No: 123310-03-2 Catalog No: AG00HH88 MDL No:MFCD06739724
Product Description
Catalog Number:
AG00HH88
Chemical Name:
N-[4-(3,4-Dimethoxyphenyl)-1,3-thiazol-2-yl]guanidine
CAS Number:
123310-03-2
Molecular Formula:
C12H14N4O2S
Molecular Weight:
278.3302
MDL Number:
MFCD06739724
IUPAC Name:
2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]guanidine
InChI:
InChI=1S/C12H14N4O2S/c1-17-9-4-3-7(5-10(9)18-2)8-6-19-12(15-8)16-11(13)14/h3-6H,1-2H3,(H4,13,14,15,16)
InChI Key:
ZLYHAVSLJFITEK-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)c1csc(n1)NC(=N)N
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.084g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
278.33g/mol
Monoisotopic Mass:
278.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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