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142187-35-7 | 2H-1-Benzopyran, 6-chloro-2-(4-chlorophenyl)-3,4-dihydro-, (2S)-
CAS No: 142187-35-7 Catalog No: AG001HXN MDL No:
Product Description
Catalog Number:
AG001HXN
Chemical Name:
2H-1-Benzopyran, 6-chloro-2-(4-chlorophenyl)-3,4-dihydro-, (2S)-
CAS Number:
142187-35-7
Molecular Formula:
C15H12Cl2O
Molecular Weight:
279.1612
IUPAC Name:
6-chloro-2-(4-chlorophenyl)-3,4-dihydro-2H-chromene
InChI:
InChI=1S/C15H12Cl2O/c16-12-4-1-10(2-5-12)14-7-3-11-9-13(17)6-8-15(11)18-14/h1-2,4-6,8-9,14H,3,7H2
InChI Key:
WDNAQQJUMPVRGM-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)[C@@H]1CCc2c(O1)ccc(c2)Cl
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.027g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.16g/mol
Monoisotopic Mass:
278.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
Literature
| Title | Journal |
|---|---|
| Design, synthesis and in vitro evaluation of novel chroman-4-one, chroman, and 2H-chromene derivatives as human rhinovirus capsid-binding inhibitors. | Bioorganic & medicinal chemistry 20111215 |
| New 4H-chromen-4-one and 2H-chromene derivatives as anti-picornavirus capsid-binders. | Bioorganic & medicinal chemistry 20100901 |
| Synthesis and antirhinovirus activity of new 3-benzyl chromene and chroman derivatives. | Bioorganic & medicinal chemistry 20090515 |
| A comparative test of fifteen compounds against all known human rhinovirus serotypes as a basis for a more rational screening program. | Antiviral research 19911001 |
| Antirhinovirus activity of 6-anilino-9-benzyl-2-chloro-9H-purines. | Journal of medicinal chemistry 19900501 |
| Synthesis and structure-activity relationships of 2-substituted-6-(dimethylamino)-9-(4-methylbenzyl)-9H-purines with antirhinovirus activity. | Journal of medicinal chemistry 19890101 |
| 9-Benzyl-6-(dimethylamino)-9H-purines with antirhinovirus activity. | Journal of medicinal chemistry 19881001 |
| 3,4-Dihydro-2-phenyl-2H-pyrano[2,3-b]pyridines with potent antirhinovirus activity. | Journal of medicinal chemistry 19860901 |
| [[(4,5-Dihydro-2-oxazolyl)phenoxy]alkyl]isoxazoles. Inhibitors of picornavirus uncoating. | Journal of medicinal chemistry 19851201 |
| Isoxazoles with antipicornavirus activity. | Journal of medicinal chemistry 19850601 |
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