D186-0062 Screening compound: 2-[2-(1-hydroxypropyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide

D186-0062 Screening compound: 2-[2-(1-hydroxypropyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide
D186-0062 Screening compound: 2-[2-(1-hydroxypropyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D186-0062
2-[2-(1-hydroxypropyl)-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

D186-0062

Molecular Formula

C21H25N3O2 (C21 H25 N3 O2)

Compound Name

2-[2-(1-hydroxypropyl)-1H-1,3-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide

IUPAC name

2-[2-(1-hydroxypropyl)-1H-13-benzodiazol-1-yl]-N-phenyl-N-(propan-2-yl)acetamide

SMILES

CCC(c1nc(cccc2)c2n1CC(N(C(C)C)c1ccccc1)=O)O

InChI

InChI=1S/C21H25N3O2/c1-4-19(25)21-22-17-12-8-9-13-18(17)23(21)14-20(26)24(15(2)3)16-10-6-5-7-11-16/h5-13,15,19,25H,4,14H2,1-3H3/t19-/m0/s1

InChI Key

MAJMJEKGJLZZFA-IBGZPJMESA-N

MDL Number (MFCD)

MFCD08144000

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.592

Distribution Coefficient, logD

3.589

Water Solubility, LogSw

-3.40

Polar Surface Area

41.538

Acid Dissociation Constant (pKa)

14.91

Base Dissociation Constant (pKb)

5.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

D186-0062 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

PI3K-Targeted Library (17255 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D186-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D186-0062?
Check Price and Availability of D186-0062, 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 D186-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D186-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D186-0062
  • 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 D186-0062 available by request