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124728-32-1 | 1-Propanethiol, 3-[[3-(methylamino)propyl]amino]-
CAS No: 124728-32-1 Catalog No: AG000MOC MDL No:
Product Description
Catalog Number:
AG000MOC
Chemical Name:
1-Propanethiol, 3-[[3-(methylamino)propyl]amino]-
CAS Number:
124728-32-1
Molecular Formula:
C7H18N2S
Molecular Weight:
162.2962
IUPAC Name:
3-[3-(methylamino)propylamino]propane-1-thiol
InChI:
InChI=1S/C7H18N2S/c1-8-4-2-5-9-6-3-7-10/h8-10H,2-7H2,1H3
InChI Key:
QHNPGBQIQCPASE-UHFFFAOYSA-N
SMILES:
CNCCCNCCCS
Properties
Complexity:
59.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.119g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
162.295g/mol
Monoisotopic Mass:
162.119g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
25.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Organic thiophosphate WR-151327 suppresses expression of HIV in chronically infected cells. | AIDS research and human retroviruses 19940601 |
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