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Home > Indoles and Oxindole > 25576-64-1
25576-64-1 | 3a,8a-Dimethyl-3,3a,8,8a-tetrahydro-2H-furo[2,3-b]indole
CAS No: 25576-64-1 Catalog No: AG01F2IY MDL No:
Product Description
Catalog Number:
AG01F2IY
Chemical Name:
3a,8a-Dimethyl-3,3a,8,8a-tetrahydro-2H-furo[2,3-b]indole
CAS Number:
25576-64-1
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
IUPAC Name:
3a,8b-dimethyl-2,4-dihydro-1H-furo[2,3-b]indole
InChI:
InChI=1S/C12H15NO/c1-11-7-8-14-12(11,2)13-10-6-4-3-5-9(10)11/h3-6,13H,7-8H2,1-2H3
InChI Key:
VMUKXPKOVINFFM-UHFFFAOYSA-N
SMILES:
CC12CCOC2(C)Nc2c1cccc2
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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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