4135-0023 Screening compound: 2-(5-benzoylfuran-2-yl)-1-methyl-1H-phenanthro[9,10-d]imidazole

4135-0023 Screening compound: 2-(5-benzoylfuran-2-yl)-1-methyl-1H-phenanthro[9,10-d]imidazole
4135-0023 Screening compound: 2-(5-benzoylfuran-2-yl)-1-methyl-1H-phenanthro[9,10-d]imidazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4135-0023
2-(5-benzoylfuran-2-yl)-1-methyl-1H-phenanthro[9,10-d]imidazole

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

4135-0023

Molecular Formula

C27H18N2O2 (C27 H18 N2 O2)

Compound Name

2-(5-benzoylfuran-2-yl)-1-methyl-1H-phenanthro[9,10-d]imidazole

IUPAC name

2-(5-benzoylfuran-2-yl)-1-methyl-1H-phenanthro[910-d]imidazole

SMILES

Cn1c(-c2ccc(C(c3ccccc3)=O)o2)nc2c1c1ccccc1c1ccccc12

InChI

InChI=1S/C27H18N2O2/c1-29-25-21-14-8-6-12-19(21)18-11-5-7-13-20(18)24(25)28-27(29)23-16-15-22(31-23)26(30)17-9-3-2-4-10-17/h2-16H,1H3

InChI Key

VYIKBEZMGONDSX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03447267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.304

Distribution Coefficient, logD

6.304

Water Solubility, LogSw

-6.05

Polar Surface Area

33.118

Acid Dissociation Constant (pKa)

25.43

Base Dissociation Constant (pKb)

2.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.70

4135-0023 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 4135-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4135-0023?
Check Price and Availability of 4135-0023, 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 4135-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4135-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4135-0023
  • 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 4135-0023 available by request