158876-83-6 Purity
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Specification
The molecular formula of Cariporide is C12H17N3O3S.
The molecular weight of Cariporide is 283.35 g/mol.
The IUPAC name of Cariporide is N-(diaminomethylidene)-3-methylsulfonyl-4-propan-2-ylbenzamide.
The InChIKey of Cariporide is IWXNYAIICFKCTM-UHFFFAOYSA-N.
The Canonical SMILES of Cariporide is CC(C)C1=C(C=C(C=C1)C(=O)N=C(N)N)S(=O)(=O)C.
The CAS number of Cariporide is 159138-80-4.
Cariporide has 2 hydrogen bond donor counts.
The XLogP3-AA value of Cariporide is 1.2.
Cariporide has 3 rotatable bond counts.
The topological polar surface area of Cariporide is 124 Å2.
Reference: [1] Patent: WO2005/79803, 2005, A1, . Location in patent: Page/Page column 41
Reference: [1] Patent: WO2005/79803, 2005, A1,
Reference: [1] Patent: WO2005/79803, 2005, A1,
Reference: [1]Patent: WO2005/79803,2005,A1 .Location in patent: Page/Page column 41