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88147-87-9 | Thiourea, 1-pyrrolidinyl-
CAS No: 88147-87-9 Catalog No: AG004GCC MDL No:
Product Description
Catalog Number:
AG004GCC
Chemical Name:
Thiourea, 1-pyrrolidinyl-
CAS Number:
88147-87-9
Molecular Formula:
C5H11N3S
Molecular Weight:
145.2259
IUPAC Name:
pyrrolidin-1-ylthiourea
InChI:
InChI=1S/C5H11N3S/c6-5(9)7-8-3-1-2-4-8/h1-4H2,(H3,6,7,9)
InChI Key:
LUZJFNYVKQEEGM-UHFFFAOYSA-N
SMILES:
NC(=S)NN1CCCC1
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.067g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
145.224g/mol
Monoisotopic Mass:
145.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| N-4-methansulfonamidobenzyl-N'-2-substituted-4-tert-butyl-benzyl thioureas as potent vanilloid receptor antagonistic ligands. | Bioorganic & medicinal chemistry letters 20040405 |
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