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Home > Pyridines > 869472-59-3
869472-59-3 | 4-CYCLOPROPYL-4,5,6,7-TETRAHYDRO-THIENO[3,2-C]PYRIDINE
CAS No: 869472-59-3 Catalog No: AG00GSR2 MDL No:MFCD07345654
Product Description
Catalog Number:
AG00GSR2
Chemical Name:
4-CYCLOPROPYL-4,5,6,7-TETRAHYDRO-THIENO[3,2-C]PYRIDINE
CAS Number:
869472-59-3
Molecular Formula:
C10H13NS
Molecular Weight:
179.2819
MDL Number:
MFCD07345654
IUPAC Name:
4-cyclopropyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
InChI:
InChI=1S/C10H13NS/c1-2-7(1)10-8-4-6-12-9(8)3-5-11-10/h4,6-7,10-11H,1-3,5H2
InChI Key:
YLISNFNPLLPBMW-UHFFFAOYSA-N
SMILES:
C1NC(C2CC2)c2c(C1)scc2
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.077g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.281g/mol
Monoisotopic Mass:
179.077g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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