Chlorotrianisene
From DrugPedia: A Wikipedia for Drug discovery
(Difference between revisions)
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</jmol> | </jmol> | ||
</td></tr></table> | </td></tr></table> | ||
| - | == | + | {{Drugbox |
| - | [http:// | + | | IUPAC_name = 1-[2-chloro-1,2-bis(4-methoxyphenyl)ethenyl]-4-methoxybenzene |
| + | | CAS_number = 569-57-3 | ||
| + | | CAS_supplemental = | ||
| + | | ATC_suffix = CA06 | ||
| + | | ATC_supplemental = | ||
| + | | PubChem = 11289 | ||
| + | | ChemSpiderID = | ||
| + | | DrugBank = APRD00715 | ||
| + | | chemical_formula =C<sub>2</sub><sub>3</sub>H<sub>2</sub><sub>1</sub>ClO<sub>3</sub> | ||
| + | | molecular_weight = 380.86 | ||
| + | | smiles = COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)Cl)C3=CC=C(C=C3)OC | ||
| + | | synonyms = | ||
| + | | density = | ||
| + | | melting_point = 115(EXP) | ||
| + | | boiling_point = | ||
| + | | solubility = | ||
| + | | specific_rotation = | ||
| + | | sec_combustion = | ||
| + | | bioavailability = | ||
| + | | protein_bound = | ||
| + | | metabolism = | ||
| + | | elimination_half-life = | ||
| + | | excretion = | ||
| + | | pregnancy_category= | ||
| + | | dependency_liability = | ||
| + | | routes_of_administration = | ||
| + | }} | ||
| + | [http://crdd.osdd.net/raghava/hmrbase/test_extract.php?db=arun&table=nphormonet&id=1027&show=SHOW-3D Show 3-D Structure] | ||
A powerful synthetic, non-steroidal estrogen. | A powerful synthetic, non-steroidal estrogen. | ||
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*[http://www.drugbank.ca/drugs/DB00269]Drugbank | *[http://www.drugbank.ca/drugs/DB00269]Drugbank | ||
| - | [[ | + | [[Category:Hormones]] |
Current revision
|
|
| Chlorotrianisene
| |
| Systematic (IUPAC) name | |
| 1-[2-chloro-1,2-bis(4-methoxyphenyl)ethenyl]-4-methoxybenzene | |
| Identifiers | |
| CAS number | |
| ATC code | ? |
| PubChem | |
| DrugBank | |
| Chemical data | |
| Formula | C23H21ClO3 |
| Mol. mass | 380.86 |
| SMILES | & |
| Physical data | |
| Melt. point | 115(EXP) °C |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
A powerful synthetic, non-steroidal estrogen.
[edit] General Properties
*Molecular Weight
380.86
*Molecular Formula
C23H21ClO3
*IUPAC NAME
1-[2-chloro-1,2-bis(4-methoxyphenyl)ethenyl]-4-methoxybenzene
*Canonical Smiles
COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)Cl)C3=CC=C(C=C3)OC
*Isomeric Smiles
[edit] PhysioChemical Properties
*Melting Point
115(EXP)
*LogP
6.22(EST)
*Water Solubility
