Chemical identity

Dasatinib N-Deshydroxyethyl Impurity / Dasatinib Metabolite M4 (HCl Salt)

CAS 1852573-26-2 · C20H23Cl2N7OS

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-12045
PubChem CID129105048
NameDasatinib N-Deshydroxyethyl Impurity / Dasatinib Metabolite M4 (HCl Salt)
CAS RN1852573-26-2
Molecular formulaC20H23Cl2N7OS
Molecular weight480.41 g/mol
IUPAC nameN-(2-chloro-6-methylphenyl)-2-((2-methyl-6-(piperazin-1-yl)pyrimidin-4-yl)amino)thiazole-5-carboxamide hydrochloride
InChIKeyZCASOULVOIEBQX-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 129105048
2D structure: Dasatinib N-Deshydroxyethyl Impurity / Dasatinib Metabolite M4 (HCl Salt), CAS 1852573-26-2
Structure of Dasatinib N-Deshydroxyethyl Impurity / Dasatinib Metabolite M4 (HCl Salt) (CAS 1852573-26-2). LazyChem record. Source identity: PubChem CID 129105048. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC20H23Cl2N7OS
InChIKeyZCASOULVOIEBQX-UHFFFAOYSA-N
Ring count4
Defined stereocentres0
Unassigned stereocentres0
SMILESO=C(C1=CN=C(NC2=NC(C)=NC(N3CCNCC3)=C2)S1)NC4=C(C)C=CC=C4Cl.[H]Cl
InChIInChI=1S/C20H22ClN7OS.ClH/c1-12-4-3-5-14(21)18(12)27-19(29)15-11-23-20(30-15)26-16-10-17(25-13(2)24-16)28-8-6-22-7-9-28;/h3-5,10-11,22H,6-9H2,1-2H3,(H,27,29)(H,23,24,25,26);1H

03Possible N-nitroso structures

A record-level structural review indicates a possible N-nitroso candidate. This is not a confirmed impurity, formation prediction or analytical finding.

Possible structure candidateUnconfirmed identity
Possible N-nitroso structural candidate related to Dasatinib N-Deshydroxyethyl Impurity / Dasatinib Metabolite M4 (HCl Salt), CAS 1852573-26-2
No CAS number, formation claim or analytical confirmation is assigned.

A structural result alone does not establish that a nitrosamine forms. A process-specific and analytical assessment is required.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 1852573-26-2 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 1852573-26-2 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Dasatinib

View API and impurity family

Other names

  • Dasatinib N-Deshydroxyethyl Impurity (HCl Salt)
  • Dasatinib Metabolite M4

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources