L628-0583 Screening compound: 2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide

L628-0583 Screening compound: 2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
L628-0583 Screening compound: 2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L628-0583
2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide

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

L628-0583

Molecular Formula

C21H29N3O4S2 (C21 H29 N3 O4 S2)

Compound Name

2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide

IUPAC name

2-{1-[(35-dimethyl-12-oxazol-4-yl)sulfonyl]piperidin-4-yl}-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide

SMILES

CC(C(CC1)CCN1S(c1c(C)onc1C)(=O)=O)C(NCc(cc1)ccc1SC)=O

InChI

InChI=1S/C21H29N3O4S2/c1-14(21(25)22-13-17-5-7-19(29-4)8-6-17)18-9-11-24(12-10-18)30(26,27)20-15(2)23-28-16(20)3/h5-8,14,18H,9-13H2,1-4H3,(H,22,25)/t14-/m0/s1

InChI Key

KXSMQCLXVGZPRG-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27466274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.61

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.481

Distribution Coefficient, logD

2.481

Water Solubility, LogSw

-2.75

Polar Surface Area

78.401

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

-2.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.40

L628-0583 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L628-0583 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L628-0583?
Check Price and Availability of L628-0583, 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 L628-0583 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L628-0583
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L628-0583
  • 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 L628-0583 available by request