Y080-1655 Screening compound: 4-[1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-yl]-1-(2-methylphenyl)-2-pyrrolidinone

Y080-1655 Screening compound: 4-[1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-yl]-1-(2-methylphenyl)-2-pyrrolidinone
Y080-1655 Screening compound: 4-[1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-yl]-1-(2-methylphenyl)-2-pyrrolidinone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1655
4-[1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-yl]-1-(2-methylphenyl)-2-pyrrolidinone

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

Y080-1655

Molecular Formula

C25H21Cl2N3O (C25 H21 Cl2 N3 O)

Compound Name

4-[1-(2,4-dichlorobenzyl)-1H-1,3-benzimidazol-2-yl]-1-(2-methylphenyl)-2-pyrrolidinone

IUPAC name

4-{1-[(24-dichlorophenyl)methyl]-1H-13-benzodiazol-2-yl}-1-(2-methylphenyl)pyrrolidin-2-one

SMILES

Cc(cccc1)c1N(CC(C1)c2nc(cccc3)c3n2Cc(ccc(Cl)c2)c2Cl)C1=O

InChI

InChI=1S/C25H21Cl2N3O/c1-16-6-2-4-8-22(16)29-15-18(12-24(29)31)25-28-21-7-3-5-9-23(21)30(25)14-17-10-11-19(26)13-20(17)27/h2-11,13,18H,12,14-15H2,1H3/t18-/m0/s1

InChI Key

MFZFNMKIQKHQLV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD04029873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.477

Distribution Coefficient, logD

6.477

Water Solubility, LogSw

-6.06

Polar Surface Area

26.344

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with Y080-1655 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1655?
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What is the minimum amount of Y080-1655 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1655
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1655
  • 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 Y080-1655 available by request