Y044-4865 Screening compound: 1-(cyclopropylmethyl)-4,6-dimethyl-3-{[4-(methylsulfonyl)piperazino]carbonyl}-2(1H)-pyridinone

Y044-4865 Screening compound: 1-(cyclopropylmethyl)-4,6-dimethyl-3-{[4-(methylsulfonyl)piperazino]carbonyl}-2(1H)-pyridinone
Y044-4865 Screening compound: 1-(cyclopropylmethyl)-4,6-dimethyl-3-{[4-(methylsulfonyl)piperazino]carbonyl}-2(1H)-pyridinone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y044-4865
1-(cyclopropylmethyl)-4,6-dimethyl-3-{[4-(methylsulfonyl)piperazino]carbonyl}-2(1H)-pyridinone

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

Y044-4865

Molecular Formula

C17H25N3O4S (C17 H25 N3 O4 S)

Compound Name

1-(cyclopropylmethyl)-4,6-dimethyl-3-{[4-(methylsulfonyl)piperazino]carbonyl}-2(1H)-pyridinone

IUPAC name

1-(cyclopropylmethyl)-3-(4-methanesulfonylpiperazine-1-carbonyl)-46-dimethyl-12-dihydropyridin-2-one

SMILES

CC(C=C(C)N1CC2CC2)=C(C(N(CC2)CCN2S(C)(=O)=O)=O)C1=O

InChI

InChI=1S/C17H25N3O4S/c1-12-10-13(2)20(11-14-4-5-14)17(22)15(12)16(21)18-6-8-19(9-7-18)25(3,23)24/h10,14H,4-9,11H2,1-3H3

InChI Key

QLWZMFIHRAXMFP-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.872

Distribution Coefficient, logD

0.872

Water Solubility, LogSw

-1.44

Polar Surface Area

63.881

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

-3.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.71

References: we are preparing a list of scientific research reports with Y044-4865 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y044-4865?
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What is the minimum amount of Y044-4865 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y044-4865
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y044-4865
  • 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 Y044-4865 available by request