D011-2948 Screening compound: 2-methyl-N-{2-[1-(2-phenylethyl)-1H-1,3-benzodiazol-2-yl]ethyl}propanamide

D011-2948 Screening compound: 2-methyl-N-{2-[1-(2-phenylethyl)-1H-1,3-benzodiazol-2-yl]ethyl}propanamide
D011-2948 Screening compound: 2-methyl-N-{2-[1-(2-phenylethyl)-1H-1,3-benzodiazol-2-yl]ethyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D011-2948
2-methyl-N-{2-[1-(2-phenylethyl)-1H-1,3-benzodiazol-2-yl]ethyl}propanamide

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

D011-2948

Molecular Formula

C21H25N3O (C21 H25 N3 O)

Compound Name

2-methyl-N-{2-[1-(2-phenylethyl)-1H-1,3-benzodiazol-2-yl]ethyl}propanamide

IUPAC name

2-methyl-N-{2-[1-(2-phenylethyl)-1H-13-benzodiazol-2-yl]ethyl}propanamide

SMILES

CC(C)C(NCCc1nc(cccc2)c2n1CCc1ccccc1)=O

InChI

InChI=1S/C21H25N3O/c1-16(2)21(25)22-14-12-20-23-18-10-6-7-11-19(18)24(20)15-13-17-8-4-3-5-9-17/h3-11,16H,12-15H2,1-2H3,(H,22,25)

InChI Key

QIZFDMOFHFYOSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04217731

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.744

Distribution Coefficient, logD

3.743

Water Solubility, LogSw

-3.93

Polar Surface Area

35.648

Acid Dissociation Constant (pKa)

14.46

Base Dissociation Constant (pKb)

4.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D011-2948 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antifungal Library (16415 compounds)

CNS BBB Library (22607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D011-2948 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D011-2948?
Check Price and Availability of D011-2948, 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 D011-2948 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D011-2948
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D011-2948
  • 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 D011-2948 available by request