F249-0171 Screening compound: N-[3-(4-benzylpiperidin-1-yl)propyl]-4-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanamide

F249-0171 Screening compound: N-[3-(4-benzylpiperidin-1-yl)propyl]-4-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanamide
F249-0171 Screening compound: N-[3-(4-benzylpiperidin-1-yl)propyl]-4-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F249-0171
N-[3-(4-benzylpiperidin-1-yl)propyl]-4-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanamide

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

F249-0171

Molecular Formula

C30H37N5O2 (C30 H37 N5 O2)

Compound Name

N-[3-(4-benzylpiperidin-1-yl)propyl]-4-{3-methyl-4-oxo-3H,4H,5H-pyridazino[4,5-b]indol-5-yl}butanamide

IUPAC name

N-[3-(4-benzylpiperidin-1-yl)propyl]-4-{3-methyl-4-oxo-3H4H5H-pyridazino[45-b]indol-5-yl}butanamide

SMILES

CN(C1=O)N=Cc2c1n(CCCC(NCCCN1CCC(Cc3ccccc3)CC1)=O)c1c2cccc1

InChI

InChI=1S/C30H37N5O2/c1-33-30(37)29-26(22-32-33)25-11-5-6-12-27(25)35(29)18-7-13-28(36)31-16-8-17-34-19-14-24(15-20-34)21-23-9-3-2-4-10-23/h2-6,9-12,22,24H,7-8,13-21H2,1H3,(H,31,36)

InChI Key

WLPDNBGWWLLPOH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27109475

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.66

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.224

Distribution Coefficient, logD

1.132

Water Solubility, LogSw

-3.37

Polar Surface Area

57.025

Acid Dissociation Constant (pKa)

14.57

Base Dissociation Constant (pKb)

9.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.30

F249-0171 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 F249-0171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F249-0171?
Check Price and Availability of F249-0171, 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 F249-0171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F249-0171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F249-0171
  • 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 F249-0171 available by request