T499-0180 Screening compound: cyclobutyl[3-(3-ethyl-3H-imidazo[4,5-b]pyridin-2-yl)-1-pyrrolidinyl]methanone

T499-0180 Screening compound: cyclobutyl[3-(3-ethyl-3H-imidazo[4,5-b]pyridin-2-yl)-1-pyrrolidinyl]methanone
T499-0180 Screening compound: cyclobutyl[3-(3-ethyl-3H-imidazo[4,5-b]pyridin-2-yl)-1-pyrrolidinyl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound T499-0180
cyclobutyl[3-(3-ethyl-3H-imidazo[4,5-b]pyridin-2-yl)-1-pyrrolidinyl]methanone

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

T499-0180

Molecular Formula

C17H22N4O (C17 H22 N4 O)

Compound Name

cyclobutyl[3-(3-ethyl-3H-imidazo[4,5-b]pyridin-2-yl)-1-pyrrolidinyl]methanone

IUPAC name

1-cyclobutanecarbonyl-3-{3-ethyl-3H-imidazo[45-b]pyridin-2-yl}pyrrolidine

SMILES

CCn1c(nccc2)c2nc1C(CC1)CN1C(C1CCC1)=O

InChI

InChI=1S/C17H22N4O/c1-2-21-15(19-14-7-4-9-18-16(14)21)13-8-10-20(11-13)17(22)12-5-3-6-12/h4,7,9,12-13H,2-3,5-6,8,10-11H2,1H3/t13-/m1/s1

InChI Key

UKSPVJNDRMUHDE-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD29024926

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.926

Distribution Coefficient, logD

1.925

Water Solubility, LogSw

-1.96

Polar Surface Area

37.269

Acid Dissociation Constant (pKa)

21.59

Base Dissociation Constant (pKb)

3.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.82

T499-0180 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with T499-0180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T499-0180?
Check Price and Availability of T499-0180, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of T499-0180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T499-0180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T499-0180
  • 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 T499-0180 available by request