Y080-1382 Screening compound: N-methyl-2-(2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1H-1,3-benzodiazol-1-yl)-N-phenylacetamide

Y080-1382 Screening compound: N-methyl-2-(2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1H-1,3-benzodiazol-1-yl)-N-phenylacetamide
Y080-1382 Screening compound: N-methyl-2-(2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1H-1,3-benzodiazol-1-yl)-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y080-1382
N-methyl-2-(2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1H-1,3-benzodiazol-1-yl)-N-phenylacetamide

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

Y080-1382

Molecular Formula

C28H31N3O (C28 H31 N3 O)

Compound Name

N-methyl-2-(2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1H-1,3-benzodiazol-1-yl)-N-phenylacetamide

IUPAC name

N-methyl-2-(2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1H-13-benzodiazol-1-yl)-N-phenylacetamide

SMILES

CC(C)Cc1ccc(C(C)c2nc(cccc3)c3n2CC(N(C)c2ccccc2)=O)cc1

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.57

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.413

Distribution Coefficient, logD

6.411

Water Solubility, LogSw

-5.75

Polar Surface Area

25.009

Acid Dissociation Constant (pKa)

16.85

Base Dissociation Constant (pKb)

5.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.57

Y080-1382 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y080-1382 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y080-1382?
Check Price and Availability of Y080-1382, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y080-1382 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y080-1382
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y080-1382
  • 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 Y080-1382 available by request