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147751-30-2 | Thiourea, N-(5-chloro-2-methylphenyl)-N'-propyl-
CAS No: 147751-30-2 Catalog No: AG001F51 MDL No:
Product Description
Catalog Number:
AG001F51
Chemical Name:
Thiourea, N-(5-chloro-2-methylphenyl)-N'-propyl-
CAS Number:
147751-30-2
Molecular Formula:
C11H15ClN2S
Molecular Weight:
242.7682
IUPAC Name:
1-(5-chloro-2-methylphenyl)-3-propylthiourea
InChI:
InChI=1S/C11H15ClN2S/c1-3-6-13-11(15)14-10-7-9(12)5-4-8(10)2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15)
InChI Key:
YOXYULLTHVLPOE-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1NC(=S)NCCC)Cl
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.064g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.765g/mol
Monoisotopic Mass:
242.064g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Biological evaluation of 1-alkyl-3-phenylthioureas as orally active HDL-elevating agents. | Bioorganic & medicinal chemistry letters 20060101 |
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