8020-1632 Screening compound: 3-(1-pyrrolidinyl)-2,7,8,9-tetrahydro-1H-cyclopenta[4,5]pyrido[2,3-d]pyrimidin-1-one

8020-1632 Screening compound: 3-(1-pyrrolidinyl)-2,7,8,9-tetrahydro-1H-cyclopenta[4,5]pyrido[2,3-d]pyrimidin-1-one
8020-1632 Screening compound: 3-(1-pyrrolidinyl)-2,7,8,9-tetrahydro-1H-cyclopenta[4,5]pyrido[2,3-d]pyrimidin-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-1632
3-(1-pyrrolidinyl)-2,7,8,9-tetrahydro-1H-cyclopenta[4,5]pyrido[2,3-d]pyrimidin-1-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8020-1632

Molecular Formula

C14H16N4O (C14 H16 N4 O)

Compound Name

3-(1-pyrrolidinyl)-2,7,8,9-tetrahydro-1H-cyclopenta[4,5]pyrido[2,3-d]pyrimidin-1-one

IUPAC name

11-(pyrrolidin-1-yl)-81012-triazatricyclo[7.4.0.0^{26}]trideca-1(9)2(6)710-tetraen-13-one

SMILES

O=C1NC(N2CCCC2)=Nc2c1c(CCC1)c1cn2

InChI

InChI=1S/C14H16N4O/c19-13-11-10-5-3-4-9(10)8-15-12(11)16-14(17-13)18-6-1-2-7-18/h8H,1-7H2,(H,15,16,17,19)

InChI Key

LRYMNTTXQQGTIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12029924

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.160

Distribution Coefficient, logD

2.058

Water Solubility, LogSw

-2.65

Polar Surface Area

48.323

Acid Dissociation Constant (pKa)

8.00

Base Dissociation Constant (pKb)

5.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

8020-1632 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS BBB Library (22607 compounds)

GPCR Targeted Library (31838 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with 8020-1632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-1632?
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What is the minimum amount of 8020-1632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-1632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-1632
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8020-1632 available by request