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Structure

Hydroxymethyl dasatinib

CAS
910297-58-4
Catalog Number
ACM910297584
Category
Other Products
Molecular Weight
504.00
Molecular Formula
C22H26ClN7O3S

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Specification

Synonyms
N-[2-Chloro-6-(hydroxymethyl)phenyl]-2-[[6-[4-(2-hydroxyethyl)-1-piperazinyl]-2-methyl-4-pyrimidinyl]amino]-5-thiazolecarboxamide
What is the molecular formula of hydroxymethyl dasatinib?

The molecular formula of hydroxymethyl dasatinib is C22H26ClN7O3S.

When was hydroxymethyl dasatinib created?

Hydroxymethyl dasatinib was created on November 6, 2006.

What is the molecular weight of hydroxymethyl dasatinib?

The molecular weight of hydroxymethyl dasatinib is 504.0 g/mol.

What is the IUPAC name of hydroxymethyl dasatinib?

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.

What is the InChIKey of hydroxymethyl dasatinib?

The InChIKey of hydroxymethyl dasatinib is KZNOWBHQESWSTD-UHFFFAOYSA-N.

What is the Canonical SMILES of hydroxymethyl dasatinib?

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.

What is the UNII of hydroxymethyl dasatinib?

The UNII of hydroxymethyl dasatinib is O4S6Z9X0XS.

What is the XLogP3-AA value of hydroxymethyl dasatinib?

The XLogP3-AA value of hydroxymethyl dasatinib is 2.9.

How many hydrogen bond donor counts are there in hydroxymethyl dasatinib?

There are 4 hydrogen bond donor counts in hydroxymethyl dasatinib.

Is the compound canonicalized for hydroxymethyl dasatinib?

Yes, the compound is canonicalized for hydroxymethyl dasatinib.

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