Galunisertib

C22H19N5OCAS 700874-72-2369.43 g/mol

NNNNH2ON

Properties

Molecular formula
C22H19N5O
Molar mass
369.43 g/mol
Exact mass
369.1590 Da
logP
4.30Crippen estimate
Polar surface area
87.7 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
700874-72-2
SMILES
Cc1cccc(-c2nn3c(c2-c2ccnc4ccc(C(=N)O)cc24)CCC3)n1
InChIKey
IVRXNBXKWIJUQB-UHFFFAOYSA-N
InChI
InChI=1S/C22H19N5O/c1-13-4-2-5-18(25-13)21-20(19-6-3-11-27(19)26-21)15-9-10-24-17-8-7-14(22(23)28)12-16(15)17/h2,4-5,7-10,12H,3,6,11H2,1H3,(H2,23,28)

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Names and synonyms

3 names
  • 6-Quinolinecarboxamide, 4-[5,6-dihydro-2-(6-methyl-2-pyridinyl)-4H-pyrrolo[1,2-b]pyrazol-3-yl]-
  • 4-[5,6-Dihydro-2-(6-methyl-2-pyridinyl)-4H-pyrrolo[1,2-b]pyrazol-3-yl]-6-quinolinecarboxamide
  • LY 2157299

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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