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Structure
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| Relationships |
Total Number of functionally related protein(s) :
104
Total Number of Articles : 113
|
| PubChem |
2267
|
| Molecular Formula |
C22H24ClN3O |
| SMILES |
CN1CCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl |
| InChI |
InChI=1S/C22H24ClN3O/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3 |
| synonyms |
- azelastine
- 58581-89-8
- 4-(4-chlorobenzyl)-2-(1-methylazepan-4-yl)phthalazin-1(2H)-one
- Azelastina
- Azelastinum
- Azelastinum [INN-Latin]
- Azelastina [INN-Spanish]
- 4-[(4-chlorophenyl)methyl]-2-(1-methylazepan-4-yl)phthalazin-1-one
- 4-(p-Chlorobenzyl)-2-(hexahydro-1-methyl-1H-azepin-4-yl)-1-(2H)-phthalazinone
- Azelastine (INN)
- (+-)-Azelastine
- UNII-ZQI909440X
- BRN 0900747
- CHEBI:2950
- HSDB 7991
- ZQI909440X
- CHEMBL639
- NSC-758971
- DTXSID6022638
- Optilast
- NSC 758971
- AZELASTINE [INN]
- Azelastinum (INN-Latin)
- Azelastina (INN-Spanish)
- Azelastine [INN:BAN]
- 1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(hexahydro-1-methyl-1H-azepin-4-yl)-
- 1(2H)-Phthalazinone,4-[(4-chlorophenyl)methyl]-2-(hexahydro-1-methyl-1H-azepin-4-yl)-
- 4-[(4-chlorophenyl)methyl]-2-(1-methylazepan-4-yl)-1,2-dihydrophthalazin-1-one
- Optivar (TN)
- 758637-88-6
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|
| Properties |
| Property |
Value |
| MW |
381.9 g/mol |
| HBD |
0 |
| HBA |
3 |
| Rotatable Bond Count |
3 |
| Exact Mass |
381.1607901 g/mol |
| Monoisotopic Mass |
381.1607901 g/mol |
| Heavy Atom Count |
27 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
1 |
| Covalent Unit Count |
1 |
| Complexity |
558 |
| xlogp |
4.4 |
| Topological Polar Surface Area |
35.9 |
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