L628-0186 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}acetamide

L628-0186 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}acetamide
L628-0186 Screening compound: N-[(2,4-dimethoxyphenyl)methyl]-2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L628-0186
N-[(2,4-dimethoxyphenyl)methyl]-2-{1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-yl}acetamide

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

L628-0186

Molecular Formula

C21H29N3O6S (C21 H29 N3 O6 S)

Compound Name

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

IUPAC name

N-[(24-dimethoxyphenyl)methyl]-2-{1-[(35-dimethyl-12-oxazol-4-yl)sulfonyl]piperidin-4-yl}acetamide

SMILES

Cc1noc(C)c1S(N1CCC(CC(NCc(ccc(OC)c2)c2OC)=O)CC1)(=O)=O

InChI

InChI=1S/C21H29N3O6S/c1-14-21(15(2)30-23-14)31(26,27)24-9-7-16(8-10-24)11-20(25)22-13-17-5-6-18(28-3)12-19(17)29-4/h5-6,12,16H,7-11,13H2,1-4H3,(H,22,25)

InChI Key

MHJDWQJERWQQJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27466200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.086

Distribution Coefficient, logD

2.086

Water Solubility, LogSw

-2.94

Polar Surface Area

93.362

Acid Dissociation Constant (pKa)

13.82

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.40

L628-0186 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L628-0186 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L628-0186?
Check Price and Availability of L628-0186, 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 L628-0186 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L628-0186
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L628-0186
  • 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 L628-0186 available by request