5754-2999 Screening compound: N-[2-(morpholin-4-yl)-5-{4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrophthalazin-1-yl}phenyl]methanesulfonamide

5754-2999 Screening compound: N-[2-(morpholin-4-yl)-5-{4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrophthalazin-1-yl}phenyl]methanesulfonamide
5754-2999 Screening compound: N-[2-(morpholin-4-yl)-5-{4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrophthalazin-1-yl}phenyl]methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5754-2999
N-[2-(morpholin-4-yl)-5-{4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrophthalazin-1-yl}phenyl]methanesulfonamide

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

5754-2999

Molecular Formula

C26H31N5O5S (C26 H31 N5 O5 S)

Compound Name

N-[2-(morpholin-4-yl)-5-{4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrophthalazin-1-yl}phenyl]methanesulfonamide

IUPAC name

N-[2-(morpholin-4-yl)-5-{4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-34-dihydrophthalazin-1-yl}phenyl]methanesulfonamide

SMILES

CS(Nc(cc(cc1)C(c2c3cccc2)=NN(CC(N2CCCCC2)=O)C3=O)c1N1CCOCC1)(=O)=O

InChI

InChI=1S/C26H31N5O5S/c1-37(34,35)28-22-17-19(9-10-23(22)29-13-15-36-16-14-29)25-20-7-3-4-8-21(20)26(33)31(27-25)18-24(32)30-11-5-2-6-12-30/h3-4,7-10,17,28H,2,5-6,11-16,18H2,1H3

InChI Key

VJOODKWKPHVETP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03995167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.63

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.750

Distribution Coefficient, logD

1.083

Water Solubility, LogSw

-2.92

Polar Surface Area

95.817

Acid Dissociation Constant (pKa)

6.84

Base Dissociation Constant (pKb)

1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

5754-2999 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 5754-2999 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5754-2999?
Check Price and Availability of 5754-2999, 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 5754-2999 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5754-2999
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5754-2999
  • 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 5754-2999 available by request