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161715-38-4 | 3-Azetidinethiol, 1-(4,5-dihydro-2-thiazolyl)-
CAS No: 161715-38-4 Catalog No: AG001VTU MDL No:MFCD18072490
Product Description
Catalog Number:
AG001VTU
Chemical Name:
3-Azetidinethiol, 1-(4,5-dihydro-2-thiazolyl)-
CAS Number:
161715-38-4
Molecular Formula:
C6H10N2S2
Molecular Weight:
174.2870
MDL Number:
MFCD18072490
IUPAC Name:
1-(4,5-dihydro-1,3-thiazol-2-yl)azetidine-3-thiol
InChI:
InChI=1S/C6H10N2S2/c9-5-3-8(4-5)6-7-1-2-10-6/h5,9H,1-4H2
InChI Key:
WXLPEIBBDQOTFV-UHFFFAOYSA-N
SMILES:
SC1CN(C1)C1=NCCS1
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.029g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.28g/mol
Monoisotopic Mass:
174.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| A practical and facile synthesis of azetidine derivatives for oral carbapenem, L-084. | Chemical & pharmaceutical bulletin 20061001 |
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