D220-0461 Screening compound: N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-3,4,5-trimethoxybenzamide

D220-0461 Screening compound: N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-3,4,5-trimethoxybenzamide
D220-0461 Screening compound: N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D220-0461
N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-3,4,5-trimethoxybenzamide

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

D220-0461

Molecular Formula

C26H31NO5 (C26 H31 NO5)

Compound Name

N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-3,4,5-trimethoxybenzamide

IUPAC name

N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-345-trimethoxybenzamide

SMILES

CC(C)(C)c1ccc(CN(Cc2ccco2)C(c(cc2OC)cc(OC)c2OC)=O)cc1

InChI

InChI=1S/C26H31NO5/c1-26(2,3)20-11-9-18(10-12-20)16-27(17-21-8-7-13-32-21)25(28)19-14-22(29-4)24(31-6)23(15-19)30-5/h7-15H,16-17H2,1-6H3

InChI Key

OYXFLUGSCQMTKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07426437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.116

Distribution Coefficient, logD

5.116

Water Solubility, LogSw

-5.06

Polar Surface Area

46.905

Acid Dissociation Constant (pKa)

27.20

Base Dissociation Constant (pKb)

-5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

D220-0461 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with D220-0461 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D220-0461?
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What is the minimum amount of D220-0461 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D220-0461
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D220-0461
  • 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 D220-0461 available by request