D011-4595 Screening compound: 2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-N-phenyl-N-(propan-2-yl)acetamide

D011-4595 Screening compound: 2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-N-phenyl-N-(propan-2-yl)acetamide
D011-4595 Screening compound: 2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-N-phenyl-N-(propan-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D011-4595
2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-N-phenyl-N-(propan-2-yl)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

D011-4595

Molecular Formula

C20H23N3O (C20 H23 N3 O)

Compound Name

2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-N-phenyl-N-(propan-2-yl)acetamide

IUPAC name

2-(56-dimethyl-1H-13-benzodiazol-1-yl)-N-phenyl-N-(propan-2-yl)acetamide

SMILES

CC(C)N(C(Cn1c(cc(C)c(C)c2)c2nc1)=O)c1ccccc1

InChI

InChI=1S/C20H23N3O/c1-14(2)23(17-8-6-5-7-9-17)20(24)12-22-13-21-18-10-15(3)16(4)11-19(18)22/h5-11,13-14H,12H2,1-4H3

InChI Key

IHEWSUQLGWRFAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04214873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.794

Distribution Coefficient, logD

3.790

Water Solubility, LogSw

-3.94

Polar Surface Area

25.642

Acid Dissociation Constant (pKa)

17.80

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

D011-4595 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D011-4595 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D011-4595?
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What is the minimum amount of D011-4595 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D011-4595
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D011-4595
  • 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 D011-4595 available by request