L008-0047 Screening compound: N-(3-bromophenyl)-4-[6-(pyrrolidin-1-yl)pyridazin-3-yl]benzamide

L008-0047 Screening compound: N-(3-bromophenyl)-4-[6-(pyrrolidin-1-yl)pyridazin-3-yl]benzamide
L008-0047 Screening compound: N-(3-bromophenyl)-4-[6-(pyrrolidin-1-yl)pyridazin-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L008-0047
N-(3-bromophenyl)-4-[6-(pyrrolidin-1-yl)pyridazin-3-yl]benzamide

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

L008-0047

Molecular Formula

C21H19BrN4O (C21 H19 BrN4 O)

Compound Name

N-(3-bromophenyl)-4-[6-(pyrrolidin-1-yl)pyridazin-3-yl]benzamide

IUPAC name

N-(3-bromophenyl)-4-[6-(pyrrolidin-1-yl)pyridazin-3-yl]benzamide

SMILES

O=C(c(cc1)ccc1-c(cc1)nnc1N1CCCC1)Nc1cccc(Br)c1

InChI

InChI=1S/C21H19BrN4O/c22-17-4-3-5-18(14-17)23-21(27)16-8-6-15(7-9-16)19-10-11-20(25-24-19)26-12-1-2-13-26/h3-11,14H,1-2,12-13H2,(H,23,27)

InChI Key

XJMUUISXBMFUGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27225897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.819

Distribution Coefficient, logD

4.813

Water Solubility, LogSw

-4.88

Polar Surface Area

48.083

Acid Dissociation Constant (pKa)

9.41

Base Dissociation Constant (pKb)

6.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

L008-0047 in Drug Discovery

Included in Screening Libraries

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

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with L008-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L008-0047?
Check Price and Availability of L008-0047, 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 L008-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L008-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L008-0047
  • 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 L008-0047 available by request