91026-76-5 Purity
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Specification
The molecular formula of N-Deshydroxyethyl dasatinib is C20H22ClN7OS.
N-Deshydroxyethyl dasatinib was created on October 26, 2006.
The IUPAC Name of N-Deshydroxyethyl dasatinib is N-(2-chloro-6-methylphenyl)-2-[(2-methyl-6-piperazin-1-ylpyrimidin-4-yl)amino]-1,3-thiazole-5-carboxamide.
The InChIKey of N-Deshydroxyethyl dasatinib is DOBZFFWLHXORTB-UHFFFAOYSA-N.
The Canonical SMILES of N-Deshydroxyethyl dasatinib is CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=CC(=NC(=N3)C)N4CCNCC4.
The molecular weight of N-Deshydroxyethyl dasatinib is 444.0 g/mol.
N-Deshydroxyethyl dasatinib has 3 hydrogen bond donor counts.
N-Deshydroxyethyl dasatinib has 5 rotatable bond counts.
The topological polar surface area of N-Deshydroxyethyl dasatinib is 123?2.
Yes, the compound is canonicalized for N-Deshydroxyethyl dasatinib.