Y080-1461 Screening compound: 2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(3-methylphenyl)acetamide

Y080-1461 Screening compound: 2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(3-methylphenyl)acetamide
Y080-1461 Screening compound: 2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(3-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1461
2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(3-methylphenyl)acetamide

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

Y080-1461

Molecular Formula

C23H20ClN3O (C23 H20 ClN3 O)

Compound Name

2-{2-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(3-methylphenyl)acetamide

IUPAC name

2-{2-[(2-chlorophenyl)methyl]-1H-13-benzodiazol-1-yl}-N-(3-methylphenyl)acetamide

SMILES

Cc1cccc(NC(Cn2c(cccc3)c3nc2Cc(cccc2)c2Cl)=O)c1

InChI

InChI=1S/C23H20ClN3O/c1-16-7-6-9-18(13-16)25-23(28)15-27-21-12-5-4-11-20(21)26-22(27)14-17-8-2-3-10-19(17)24/h2-13H,14-15H2,1H3,(H,25,28)

InChI Key

GABSXDMUWSNFMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD13868645

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.88

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.872

Distribution Coefficient, logD

5.872

Water Solubility, LogSw

-5.93

Polar Surface Area

34.021

Acid Dissociation Constant (pKa)

12.41

Base Dissociation Constant (pKb)

4.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.04

References: we are preparing a list of scientific research reports with Y080-1461 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1461?
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What is the minimum amount of Y080-1461 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1461
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1461
  • 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 Y080-1461 available by request