D220-0331 Screening compound: N-[(furan-2-yl)methyl]-4-nitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide

D220-0331 Screening compound: N-[(furan-2-yl)methyl]-4-nitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide
D220-0331 Screening compound: N-[(furan-2-yl)methyl]-4-nitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D220-0331
N-[(furan-2-yl)methyl]-4-nitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide

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

D220-0331

Molecular Formula

C22H22N2O4 (C22 H22 N2 O4)

Compound Name

N-[(furan-2-yl)methyl]-4-nitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide

IUPAC name

N-[(furan-2-yl)methyl]-4-nitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide

SMILES

CC(C)c1ccc(CN(Cc2ccco2)C(c(cc2)ccc2[N+]([O-])=O)=O)cc1

InChI

InChI=1S/C22H22N2O4/c1-16(2)18-7-5-17(6-8-18)14-23(15-21-4-3-13-28-21)22(25)19-9-11-20(12-10-19)24(26)27/h3-13,16H,14-15H2,1-2H3

InChI Key

KGZCYOYMNMQRMM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07426594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.870

Distribution Coefficient, logD

4.870

Water Solubility, LogSw

-4.63

Polar Surface Area

57.308

Acid Dissociation Constant (pKa)

24.08

Base Dissociation Constant (pKb)

-5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with D220-0331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D220-0331?
Check Price and Availability of D220-0331, 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 D220-0331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D220-0331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D220-0331
  • 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 D220-0331 available by request