910297-51-7 Purity
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Specification
The molecular formula of hydroxymethyl dasatinib is C22H26ClN7O3S.
Hydroxymethyl dasatinib was created on November 6, 2006.
The molecular weight of hydroxymethyl dasatinib is 504.0 g/mol.
The IUPAC name of hydroxymethyl dasatinib is N-[2-chloro-6-(hydroxymethyl)phenyl]-2-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide.
The InChIKey of hydroxymethyl dasatinib is KZNOWBHQESWSTD-UHFFFAOYSA-N.
The Canonical SMILES of hydroxymethyl dasatinib is CC1=NC(=CC(=N1)N2CCN(CC2)CCO)NC3=NC=C(S3)C(=O)NC4=C(C=CC=C4Cl)CO.
The UNII of hydroxymethyl dasatinib is O4S6Z9X0XS.
The XLogP3-AA value of hydroxymethyl dasatinib is 2.9.
There are 4 hydrogen bond donor counts in hydroxymethyl dasatinib.
Yes, the compound is canonicalized for hydroxymethyl dasatinib.