N-Nitroso Abemaciclib | Identiteet

01Identiteet

Lazychem ID	LC-21433
CAS RN	Pole loetletud
PubChem CID	172990564
Molecular formula	C27H31F2N9O
Molecular weight	535.59 g/mol
IUPAC name	N-(5-((4-ethylpiperazin-1-yl)methyl)pyridin-2-yl)-N-(5-fluoro-4-(4-fluoro-1-isopropyl-2-methyl-1H-benzo[d]imidazol-6-yl)pyrimidin-2-yl)nitrous amide
InChIKey	QKONLHCXQWQPEN-UHFFFAOYSA-N

02Struktuur ja stereokeemia

Two-dimensional chemical structure of N-Nitroso Abemaciclib — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 5 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom, contains an N-nitroso substructure. These statements are calculated from the published structure string.

Defined stereocentres	0
Ring count	5
Secondary amines	0
Tertiary amines	3

SMILES	CCN1CCN(CC2=CC=C(N(C3=NC=C(F)C(C4=CC(F)=C(N=C(C)N5C(C)C)C5=C4)=N3)N=O)N=C2)CC1
InChI	Pole loetletud

03Staatus Indias

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

04Nimed ja seosed

API ja lähteravim

Abemaciclib

Lisandid ja seotud ühendid

Nimed ja seosed

Abemaciclib Nitroso Impurity 1

05Allikad

S01
PubChem CID 172990564
Structure and machine-readable chemical identifiers.