F550-3988 Screening compound: 6-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)-2-[3-oxo-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)propyl]-2,3-dihydropyridazin-3-one

F550-3988 Screening compound: 6-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)-2-[3-oxo-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)propyl]-2,3-dihydropyridazin-3-one
F550-3988 Screening compound: 6-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)-2-[3-oxo-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)propyl]-2,3-dihydropyridazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F550-3988
6-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)-2-[3-oxo-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)propyl]-2,3-dihydropyridazin-3-one

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

F550-3988

Molecular Formula

C28H28N4O3 (C28 H28 N4 O3)

Compound Name

6-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)-2-[3-oxo-3-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)propyl]-2,3-dihydropyridazin-3-one

IUPAC name

6-(2-methyl-23-dihydro-1H-indole-1-carbonyl)-2-[3-oxo-3-(4-phenyl-1236-tetrahydropyridin-1-yl)propyl]-23-dihydropyridazin-3-one

SMILES

CC(C1)N(C(C(C=C2)=NN(CCC(N(CC3)CC=C3c3ccccc3)=O)C2=O)=O)c2c1cccc2

InChI

InChI=1S/C28H28N4O3/c1-20-19-23-9-5-6-10-25(23)32(20)28(35)24-11-12-27(34)31(29-24)18-15-26(33)30-16-13-22(14-17-30)21-7-3-2-4-8-21/h2-13,20H,14-19H2,1H3/t20-/m0/s1

InChI Key

RWKPYLMDPHFUPZ-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27176049

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.463

Distribution Coefficient, logD

3.463

Water Solubility, LogSw

-3.54

Polar Surface Area

59.536

Acid Dissociation Constant (pKa)

23.25

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

F550-3988 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F550-3988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F550-3988?
Check Price and Availability of F550-3988, 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 F550-3988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F550-3988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F550-3988
  • 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 F550-3988 available by request