L629-1213 Screening compound: 2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[(4-methylphenyl)methyl]acetamide

L629-1213 Screening compound: 2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[(4-methylphenyl)methyl]acetamide
L629-1213 Screening compound: 2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[(4-methylphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L629-1213
2-{1-[(5-bromothiophen-2-yl)sulfonyl]piperidin-4-yl}-N-[(4-methylphenyl)methyl]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

L629-1213

Molecular Formula

C19H23BrN2O3S2 (C19 H23 BrN2 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

Cc1ccc(CNC(CC(CC2)CCN2S(c(s2)ccc2Br)(=O)=O)=O)cc1

InChI

InChI=1S/C19H23BrN2O3S2/c1-14-2-4-16(5-3-14)13-21-18(23)12-15-8-10-22(11-9-15)27(24,25)19-7-6-17(20)26-19/h2-7,15H,8-13H2,1H3,(H,21,23)

InChI Key

KZJHARWIEXAXBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27466624

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.109

Distribution Coefficient, logD

4.109

Water Solubility, LogSw

-4.08

Polar Surface Area

57.168

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with L629-1213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L629-1213?
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What is the minimum amount of L629-1213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L629-1213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L629-1213
  • 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 L629-1213 available by request