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Home > Other Building Blocks > 162969-98-4
162969-98-4 | 1H-[1,3]Oxazino[4,5-c]acridine, 3,4-dihydro-
CAS No: 162969-98-4 Catalog No: AG001TK9 MDL No:
Product Description
Catalog Number:
AG001TK9
Chemical Name:
1H-[1,3]Oxazino[4,5-c]acridine, 3,4-dihydro-
CAS Number:
162969-98-4
Molecular Formula:
C15H12N2O
Molecular Weight:
236.2686
IUPAC Name:
3,4-dihydro-1H-[1,3]oxazino[4,5-c]acridine
InChI:
InChI=1S/C15H12N2O/c1-2-4-13-10(3-1)7-11-5-6-14-12(15(11)17-13)8-18-9-16-14/h1-7,16H,8-9H2
InChI Key:
ITPGTZCJANLRHB-UHFFFAOYSA-N
SMILES:
O1CNc2c(C1)c1nc3ccccc3cc1cc2
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.274g/mol
Monoisotopic Mass:
236.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| 3,4-Dihydro-1H-[1,3]oxazino[4,5-c]acridines as a new family of cytotoxic drugs. | Bioorganic & medicinal chemistry letters 20060901 |
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