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149484-92-4 | Thiourea, N-[2-(4-methylphenyl)ethyl]-N'-2-thiazolyl-
CAS No: 149484-92-4 Catalog No: AG001LR5 MDL No:
Product Description
Catalog Number:
AG001LR5
Chemical Name:
Thiourea, N-[2-(4-methylphenyl)ethyl]-N'-2-thiazolyl-
CAS Number:
149484-92-4
Molecular Formula:
C13H15N3S2
Molecular Weight:
277.4083
IUPAC Name:
1-[2-(4-methylphenyl)ethyl]-3-(1,3-thiazol-2-yl)thiourea
InChI:
InChI=1S/C13H15N3S2/c1-10-2-4-11(5-3-10)6-7-14-12(17)16-13-15-8-9-18-13/h2-5,8-9H,6-7H2,1H3,(H2,14,15,16,17)
InChI Key:
SIJMMWOYIWBAFY-UHFFFAOYSA-N
SMILES:
S=C(Nc1nccs1)NCCc1ccc(cc1)C
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.071g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
277.404g/mol
Monoisotopic Mass:
277.071g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
97.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Anti-HIV activity of aromatic and heterocyclic thiazolyl thiourea compounds. | Bioorganic & medicinal chemistry letters 20010226 |
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