S634-0733 Screening compound: N~3~-[2-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(2-methoxyethyl)-3-piperidyl]-1H-pyrrole-3-carboxamide

S634-0733 Screening compound: N~3~-[2-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(2-methoxyethyl)-3-piperidyl]-1H-pyrrole-3-carboxamide
S634-0733 Screening compound: N~3~-[2-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(2-methoxyethyl)-3-piperidyl]-1H-pyrrole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S634-0733
N~3~-[2-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(2-methoxyethyl)-3-piperidyl]-1H-pyrrole-3-carboxamide

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

S634-0733

Molecular Formula

C22H29N5O2 (C22 H29 N5 O2)

Compound Name

N~3~-[2-(1H-1,3-benzimidazol-2-yl)ethyl]-2-[1-(2-methoxyethyl)-3-piperidyl]-1H-pyrrole-3-carboxamide

IUPAC name

n/a

SMILES

COCCN(CCC1)CC1c([nH]cc1)c1C(NCCc1nc(cccc2)c2[nH]1)=O

InChI

InChI=1S/C22H29N5O2/c1-29-14-13-27-12-4-5-16(15-27)21-17(8-10-23-21)22(28)24-11-9-20-25-18-6-2-3-7-19(18)26-20/h2-3,6-8,10,16,23H,4-5,9,11-15H2,1H3,(H,24,28)(H,25,26)/t16-/m0/s1

InChI Key

JFEMLMCEZAVFOL-INIZCTEOSA-N

MDL Number (MFCD)

MFCD29016819

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.276

Distribution Coefficient, logD

2.051

Water Solubility, LogSw

-2.80

Polar Surface Area

67.598

Acid Dissociation Constant (pKa)

13.46

Base Dissociation Constant (pKb)

7.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with S634-0733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S634-0733?
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What is the minimum amount of S634-0733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S634-0733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S634-0733
  • 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 S634-0733 available by request