Compound Summary


SB 206553 hydrochloride
  Compound Information
 SB 206553 hydrochloride

Compound Name:

SB 206553 hydrochloride

Compound CID:

11957707

Synonyms:

SB 206553 hydrochloride

1197334-04-5

SB 206553 HCl

3,5-DIHYDRO-5-METHYL-N-3-PYRIDINYLBENZO1,2-B:4,5-BDIPYRROLE-1(2H)-CARBOXAMIDE HYDROCHLORIDE

NCGC00094422-01

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Iupac Name:

1-methyl-N-pyridin-3-yl-6,7-dihydropyrrolo[2,3-f]indole-5-carboxamide;hydrochloride

InChI:

InChI=1S/C17H16N4O.ClH/c1-20-7-4-12-10-16-13(9-15(12)20)5-8-21(16)17(22)19-14-3-2-6-18-11-14;/h2-4,6-7,9-11H,5,8H2,1H3,(H,19,22);1H

InChIKey:

VGEMBOFBPSNOIO-UHFFFAOYSA-N

Canonical Smiles:

CN1C=CC2=CC3=C(CCN3C(=O)NC4=CN=CC=C4)C=C21.Cl

Isomeric Smiles:

CN1C=CC2=CC3=C(CCN3C(=O)NC4=CN=CC=C4)C=C21.Cl

Molecular Weight:

328.8

Molecular Formula:

C17H17ClN4O

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 SB 206553 hydrochloride

Molecular Weight:

328.8

Molecular Formula:

C17H17ClN4O

Hydrogen Bond Donor Count:

2

Hydrogen Bond Acceptor Count:

2

Rotatable Bond Count:

1

Heavy Atom Count:

23

Complexity:

429

  Synonyms
 SB 206553 hydrochloride

  Experimental Data
 SB 206553 hydrochloride

  Experimental Data Visualization
 SB 206553 hydrochloride

  Statistics Data
 SB 206553 hydrochloride

  Statistics Data Visualization
 SB 206553 hydrochloride