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1516-37-6 | Thiourea, N-(2-methoxyphenyl)-
CAS No: 1516-37-6 Catalog No: AG001NFO MDL No:MFCD00022162
Product Description
Catalog Number:
AG001NFO
Chemical Name:
Thiourea, N-(2-methoxyphenyl)-
CAS Number:
1516-37-6
Molecular Formula:
C8H10N2OS
Molecular Weight:
182.2428
MDL Number:
MFCD00022162
IUPAC Name:
(2-methoxyphenyl)thiourea
InChI:
InChI=1S/C8H10N2OS/c1-11-7-5-3-2-4-6(7)10-8(9)12/h2-5H,1H3,(H3,9,10,12)
InChI Key:
HXCHZMHFZXNFIX-UHFFFAOYSA-N
SMILES:
COc1ccccc1NC(=S)N
UNII:
XUU985ZMA2
NSC Number:
523842
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.241g/mol
Monoisotopic Mass:
182.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Structural requirement(s) of N-phenylthioureas and benzaldehyde thiosemicarbazones as inhibitors of melanogenesis in melanoma B 16 cells. | Bioorganic & medicinal chemistry letters 20100501 |
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