L629-1231 Screening compound: 2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-(3-methylbutyl)acetamide

L629-1231 Screening compound: 2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-(3-methylbutyl)acetamide
L629-1231 Screening compound: 2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-(3-methylbutyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L629-1231
2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-(3-methylbutyl)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

L629-1231

Molecular Formula

C16H25BrN2O3S2 (C16 H25 BrN2 O3 S2)

Compound Name

2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-(3-methylbutyl)acetamide

IUPAC name

2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-(3-methylbutyl)acetamide

SMILES

CC(C)CCNC(CC(CC1)CCN1S(c(s1)ccc1Br)(=O)=O)=O

InChI

InChI=1S/C16H25BrN2O3S2/c1-12(2)5-8-18-15(20)11-13-6-9-19(10-7-13)24(21,22)16-4-3-14(17)23-16/h3-4,12-13H,5-11H2,1-2H3,(H,18,20)

InChI Key

RIBAAUGQPBHRPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27466630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.553

Distribution Coefficient, logD

3.553

Water Solubility, LogSw

-3.74

Polar Surface Area

57.281

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.80

L629-1231 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L629-1231 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L629-1231?
Check Price and Availability of L629-1231, 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 L629-1231 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L629-1231
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L629-1231
  • 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 L629-1231 available by request