Account Tolvaptan phosphate ester sodium
- Catalog No. :
- ACEVMP460
- CAS No. :
- 942619-79-6
- Molecular Formula :
- C26H24ClN2Na2O6P
- Molecular Weight :
- 572.89
IUPAC Name:sodium 7-chloro-1-(2-methyl-4-(2-methylbenzamido)benzoyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl phosphate
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Product Information
| Product Name | Tolvaptan phosphate ester sodium |
|---|---|
| IUPAC Name | sodium 7-chloro-1-(2-methyl-4-(2-methylbenzamido)benzoyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl phosphate |
| Molecular Formula | C26H24ClN2Na2O6P |
| Molecular Weight | 572.89 |
| SMILES | O=P([O-])([O-])OC1C2=CC(Cl)=CC=C2N(C(C3=CC=C(NC(C4=CC=CC=C4C)=O)C=C3C)=O)CCC1.[Na+].[Na+] |
| InChI Key | IHNKFKPPZJVMMZ-UHFFFAOYSA-L |
| Synonym | Benzamide, N-[4-[[7-chloro-2,3,4,5-tetrahydro-5-(phosphonooxy)-1H-1-benzazepin-1-yl]carbonyl]-3-methylphenyl]-2-methyl-, sodium salt (1:2);Tolvaptan Impurity(Disodium salt);Tolvaptan Sodium Phosphate |
| CAS No. | 942619-79-6 |
Synthetic Route by SureRoute
2. ACEVMP460 Molecular Building Block Synthetic Route
N-(4-(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carbonyl)-3-methylphenyl)benzamide
(4-amino-2-methylphenyl)(7-chloro-5-hydroxy-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone
N-(4-(7-Chloro-5-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carbonyl)-3-methylphenyl)-2-methylbenzamide