C795-0650 Screening compound: N1-(3-METHOXYBENZYL)-4-[8-OXOFURO[2'

C795-0650 Screening compound: N1-(3-METHOXYBENZYL)-4-[8-OXOFURO[2'
C795-0650 Screening compound: N1-(3-METHOXYBENZYL)-4-[8-OXOFURO[2' alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-0650
N1-(3-METHOXYBENZYL)-4-[8-OXOFURO[2'

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

C795-0650

Molecular Formula

C20H20N4O4 (C20 H20 N4 O4)

Compound Name

N1-(3-METHOXYBENZYL)-4-[8-OXOFURO[2'

IUPAC name

n/a

SMILES

COc1cccc(CNC(CCCN(C2=O)N=Cn3c2cc2c3cco2)=O)c1

InChI

InChI=1S/C20H20N4O4/c1-27-15-5-2-4-14(10-15)12-21-19(25)6-3-8-24-20(26)17-11-18-16(7-9-28-18)23(17)13-22-24/h2,4-5,7,9-11,13H,3,6,8,12H2,1H3,(H,21,25)

InChI Key

RHNLLVKPCGEQOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14797008

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.993

Distribution Coefficient, logD

0.992

Water Solubility, LogSw

-1.92

Polar Surface Area

70.149

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.00

C795-0650 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C795-0650 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-0650?
Check Price and Availability of C795-0650, 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 C795-0650 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-0650
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-0650
  • 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 C795-0650 available by request