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27333-47-7 | 1,3,3-Trimethylspiro[indoline-2,3'-naphtho[2,1-b][1,4]oxazine]
CAS No: 27333-47-7 Catalog No: AG003DFR MDL No:MFCD00013318
Product Description
Catalog Number:
AG003DFR
Chemical Name:
1,3,3-Trimethylspiro[indoline-2,3'-naphtho[2,1-b][1,4]oxazine]
CAS Number:
27333-47-7
Molecular Formula:
C22H20N2O
Molecular Weight:
328.4070
MDL Number:
MFCD00013318
IUPAC Name:
1',3',3'-trimethylspiro[benzo[f][1,4]benzoxazine-3,2'-indole]
InChI:
InChI=1S/C22H20N2O/c1-21(2)17-10-6-7-11-18(17)24(3)22(21)14-23-20-16-9-5-4-8-15(16)12-13-19(20)25-22/h4-14H,1-3H3
InChI Key:
CQTRKDFIQFOAQV-UHFFFAOYSA-N
SMILES:
CN1c2ccccc2C(C21C=Nc1c(O2)ccc2c1cccc2)(C)C
EC Number:
404-480-6
Properties
Complexity:
558
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.158g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.415g/mol
Monoisotopic Mass:
328.158g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| Spirobipyridopyrans, spirobinaphthopyrans, indolinospiropyridopyrans, indolinospironaphthopyrans and indolinospironaphtho-1,4-oxazines: synthesis, study of X-ray crystal structure, antitumoral and antiviral evaluation. | Bioorganic & medicinal chemistry 20040301 |
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