SA95-0500 Screening compound: 2-(2-chlorophenyl)-1-(2-{5-methyl-1-[(pyridin-3-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)ethan-1-one

SA95-0500 Screening compound: 2-(2-chlorophenyl)-1-(2-{5-methyl-1-[(pyridin-3-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)ethan-1-one
SA95-0500 Screening compound: 2-(2-chlorophenyl)-1-(2-{5-methyl-1-[(pyridin-3-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA95-0500
2-(2-chlorophenyl)-1-(2-{5-methyl-1-[(pyridin-3-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)ethan-1-one

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

SA95-0500

Molecular Formula

C22H23ClN4O (C22 H23 ClN4 O)

Compound Name

2-(2-chlorophenyl)-1-(2-{5-methyl-1-[(pyridin-3-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)ethan-1-one

IUPAC name

2-(2-chlorophenyl)-1-(2-{5-methyl-1-[(pyridin-3-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)ethan-1-one

SMILES

Cc1cnc(C(CCC2)N2C(Cc(cccc2)c2Cl)=O)n1Cc1cnccc1

InChI

InChI=1S/C22H23ClN4O/c1-16-13-25-22(27(16)15-17-6-4-10-24-14-17)20-9-5-11-26(20)21(28)12-18-7-2-3-8-19(18)23/h2-4,6-8,10,13-14,20H,5,9,11-12,15H2,1H3/t20-/m0/s1

InChI Key

BOBKYNPWKBLTPQ-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD32243882

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.9

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.060

Distribution Coefficient, logD

2.695

Water Solubility, LogSw

-3.17

Polar Surface Area

36.850

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

7.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.82

References: we are preparing a list of scientific research reports with SA95-0500 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA95-0500?
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What is the minimum amount of SA95-0500 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA95-0500
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA95-0500
  • 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 SA95-0500 available by request