Spebrutinib | Identidad

01Identidad

Lazychem ID	LC-56504
CAS RN	No indicado
PubChem CID	59174488
Molecular formula	C22H22FN5O3
Molecular weight	423.4 g/mol
IUPAC name	N-[3-[[5-fluoro-2-[4-(2-methoxyethoxy)anilino]pyrimidin-4-yl]amino]phenyl]prop-2-enamide
InChIKey	KXBDTLQSDKGAEB-UHFFFAOYSA-N

02Estructura y estereoquímica

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

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	0
Ring count	3
Secondary amines	2
Tertiary amines	0

SMILES	COCCOC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC(=CC=C3)NC(=O)C=C)F
InChI	No indicado

03Estado en India

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

04Nombres y relaciones

API y fármaco de origen

No indicado

Nombres y relaciones

05Fuentes

S01
PubChem CID 59174488
Structure and machine-readable chemical identifiers.