M101-0029 Screening compound: N2-{4-[3-(1-PYRROLIDINYLCARBONYL)IMIDAZO[2

M101-0029 Screening compound: N2-{4-[3-(1-PYRROLIDINYLCARBONYL)IMIDAZO[2
M101-0029 Screening compound: N2-{4-[3-(1-PYRROLIDINYLCARBONYL)IMIDAZO[2 alternative view

Chemical Structure Depiction of ChemDiv screening compound M101-0029
N2-{4-[3-(1-PYRROLIDINYLCARBONYL)IMIDAZO[2

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

M101-0029

Molecular Formula

C21H18N4O3S (C21 H18 N4 O3 S)

Compound Name

N2-{4-[3-(1-PYRROLIDINYLCARBONYL)IMIDAZO[2

IUPAC name

n/a

SMILES

O=C(c1ccco1)Nc(cc1)ccc1-c1cn(c(C(N2CCCC2)=O)cs2)c2n1

InChI

InChI=1S/C21H18N4O3S/c26-19(18-4-3-11-28-18)22-15-7-5-14(6-8-15)16-12-25-17(13-29-21(25)23-16)20(27)24-9-1-2-10-24/h3-8,11-13H,1-2,9-10H2,(H,22,26)

InChI Key

VDDWMYGLIWWZTB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15140804

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.454

Distribution Coefficient, logD

3.454

Water Solubility, LogSw

-3.58

Polar Surface Area

57.379

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

M101-0029 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 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 M101-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M101-0029?
Check Price and Availability of M101-0029, 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 M101-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M101-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M101-0029
  • 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 M101-0029 available by request