1227-0013 Screening compound: 4-bromo-N-(4-methoxyphenyl)-3-(piperidine-1-sulfonyl)benzamide

1227-0013 Screening compound: 4-bromo-N-(4-methoxyphenyl)-3-(piperidine-1-sulfonyl)benzamide
1227-0013 Screening compound: 4-bromo-N-(4-methoxyphenyl)-3-(piperidine-1-sulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1227-0013
4-bromo-N-(4-methoxyphenyl)-3-(piperidine-1-sulfonyl)benzamide

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

1227-0013

Molecular Formula

C19H21BrN2O4S (C19 H21 BrN2 O4 S)

Compound Name

4-bromo-N-(4-methoxyphenyl)-3-(piperidine-1-sulfonyl)benzamide

IUPAC name

4-bromo-N-(4-methoxyphenyl)-3-(piperidine-1-sulfonyl)benzamide

SMILES

COc(cc1)ccc1NC(c(cc1)cc(S(N2CCCCC2)(=O)=O)c1Br)=O

InChI

InChI=1S/C19H21BrN2O4S/c1-26-16-8-6-15(7-9-16)21-19(23)14-5-10-17(20)18(13-14)27(24,25)22-11-3-2-4-12-22/h5-10,13H,2-4,11-12H2,1H3,(H,21,23)

InChI Key

MYIQWTRGCBPYRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00736213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.860

Distribution Coefficient, logD

3.855

Water Solubility, LogSw

-4.02

Polar Surface Area

62.584

Acid Dissociation Constant (pKa)

9.29

Base Dissociation Constant (pKb)

-2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with 1227-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1227-0013?
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What is the minimum amount of 1227-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1227-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1227-0013
  • 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 1227-0013 available by request