4-(((3S,4S)-1-(5-cyanothiazol-2-yl)-4-ethylpyrrolidin-3-yl)amino)-6-(6-((2-methoxyacetamido)methyl)pyridin-3-yl)pyrrolo[1,2-b]pyridazine-3-carboxamide

HCID 66548288
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Basic information

Standard SMILES
CC[C@H]1CN(c2ncc(C#N)s2)C[C@H]1Nc1c(C(N)=O)cnn2cc(-c3ccc(CNC(=O)COC)nc3)cc12
InChIKey
WKGODWFLZNHJMG-KSFYIVLOSA-N
Molecular formula
C27H29N9O3S
Average molar mass
559.6 g/mol

Names & identifiers

Preferred name
4-(((3S,4S)-1-(5-cyanothiazol-2-yl)-4-ethylpyrrolidin-3-yl)amino)-6-(6-((2-methoxyacetamido)methyl)pyridin-3-yl)pyrrolo[1,2-b]pyridazine-3-carboxamide
IUPAC
4-[[(3S,4S)-1-(5-cyano-1,3-thiazol-2-yl)-4-ethylpyrrolidin-3-yl]amino]-6-[6-[[(2-methoxyacetyl)amino]methyl]-3-pyridinyl]pyrrolo[1,2-b]pyridazine-3-carboxamide

Names & synonyms

SCHEMBL12492443WKGODWFLZNHJMG-KSFYIVLOSA-N4-(((3S,4S)-1-(5-cyanothiazol-2-yl)-4-ethylpyrrolidin-3-yl)amino)-6-(6-((2-methoxyacetamido)methyl)pyridin-3-yl)pyrrolo[1,2-b]pyridazine-3-carboxamide

Database identifiers

PubChem CID
66548288

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
192 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
10
Rotatable bonds
10
Heavy atoms
40

Related reactions

1 records
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Compound notes

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