P701-0154 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-phenyl-1,3-thiazol-2-yl)-1H-imidazol-1-yl]acetamide

P701-0154 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-phenyl-1,3-thiazol-2-yl)-1H-imidazol-1-yl]acetamide
P701-0154 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-phenyl-1,3-thiazol-2-yl)-1H-imidazol-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P701-0154
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-phenyl-1,3-thiazol-2-yl)-1H-imidazol-1-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

P701-0154

Molecular Formula

C22H18N4O3S (C22 H18 N4 O3 S)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-phenyl-1,3-thiazol-2-yl)-1H-imidazol-1-yl]acetamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-2-[4-(4-phenyl-13-thiazol-2-yl)-1H-imidazol-1-yl]acetamide

SMILES

O=C(Cn1cnc(-c2nc(-c3ccccc3)cs2)c1)Nc(cc1)cc2c1OCCO2

InChI

InChI=1S/C22H18N4O3S/c27-21(24-16-6-7-19-20(10-16)29-9-8-28-19)12-26-11-17(23-14-26)22-25-18(13-30-22)15-4-2-1-3-5-15/h1-7,10-11,13-14H,8-9,12H2,(H,24,27)

InChI Key

RYQGYHMEJPEIMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27612592

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.484

Distribution Coefficient, logD

3.484

Water Solubility, LogSw

-3.61

Polar Surface Area

60.737

Acid Dissociation Constant (pKa)

11.26

Base Dissociation Constant (pKb)

2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

P701-0154 in Drug Discovery

Included in Screening Libraries

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with P701-0154 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P701-0154?
Check Price and Availability of P701-0154, 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 P701-0154 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P701-0154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P701-0154
  • 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 P701-0154 available by request