SA95-0108 Screening compound: 1-(2-{5-methyl-1-[(pyridin-4-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)-3-phenylpropan-1-one

SA95-0108 Screening compound: 1-(2-{5-methyl-1-[(pyridin-4-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)-3-phenylpropan-1-one
SA95-0108 Screening compound: 1-(2-{5-methyl-1-[(pyridin-4-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)-3-phenylpropan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA95-0108
1-(2-{5-methyl-1-[(pyridin-4-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)-3-phenylpropan-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

SA95-0108

Molecular Formula

C23H26N4O (C23 H26 N4 O)

Compound Name

1-(2-{5-methyl-1-[(pyridin-4-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)-3-phenylpropan-1-one

IUPAC name

1-(2-{5-methyl-1-[(pyridin-4-yl)methyl]-1H-imidazol-2-yl}pyrrolidin-1-yl)-3-phenylpropan-1-one

SMILES

Cc1cnc(C(CCC2)N2C(CCc2ccccc2)=O)n1Cc1ccncc1

InChI

InChI=1S/C23H26N4O/c1-18-16-25-23(27(18)17-20-11-13-24-14-12-20)21-8-5-15-26(21)22(28)10-9-19-6-3-2-4-7-19/h2-4,6-7,11-14,16,21H,5,8-10,15,17H2,1H3/t21-/m0/s1

InChI Key

MTTJHMLCKBXRBN-NRFANRHFSA-N

MDL Number (MFCD)

MFCD32244468

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.737

Distribution Coefficient, logD

2.711

Water Solubility, LogSw

-2.44

Polar Surface Area

36.761

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.78

References: we are preparing a list of scientific research reports with SA95-0108 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA95-0108?
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What is the minimum amount of SA95-0108 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA95-0108
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA95-0108
  • 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 SA95-0108 available by request