M512-0063 Screening compound: (5-bromo-2-furyl)(1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)methanone

M512-0063 Screening compound: (5-bromo-2-furyl)(1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)methanone
M512-0063 Screening compound: (5-bromo-2-furyl)(1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound M512-0063
(5-bromo-2-furyl)(1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)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

M512-0063

Molecular Formula

C11H10BrN3O2 (C11 H10 BrN3 O2)

Compound Name

(5-bromo-2-furyl)(1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)methanone

IUPAC name

5-(5-bromofuran-2-carbonyl)-1H4H5H6H7H-imidazo[45-c]pyridine

SMILES

O=C(c(o1)ccc1Br)N(CC1)Cc2c1[nH]cn2

InChI

InChI=1S/C11H10BrN3O2/c12-10-2-1-9(17-10)11(16)15-4-3-7-8(5-15)14-6-13-7/h1-2,6H,3-5H2,(H,13,14)

InChI Key

UNTXJFOVVYBIDC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27545813

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.12

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.010

Distribution Coefficient, logD

0.941

Water Solubility, LogSw

-2.08

Polar Surface Area

49.304

Acid Dissociation Constant (pKa)

14.41

Base Dissociation Constant (pKb)

6.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.27

M512-0063 in Drug Discovery

Included in Screening Libraries

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

Fragments Library (11262 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M512-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M512-0063?
Check Price and Availability of M512-0063, 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 M512-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M512-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M512-0063
  • 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 M512-0063 available by request