D089-0415 Screening compound: N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-4-[(morpholin-4-yl)methyl]-1-benzofuran-3-carboxamide

D089-0415 Screening compound: N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-4-[(morpholin-4-yl)methyl]-1-benzofuran-3-carboxamide
D089-0415 Screening compound: N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-4-[(morpholin-4-yl)methyl]-1-benzofuran-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D089-0415
N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-4-[(morpholin-4-yl)methyl]-1-benzofuran-3-carboxamide

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

D089-0415

Molecular Formula

C22H23ClN2O4 (C22 H23 ClN2 O4)

Compound Name

N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-4-[(morpholin-4-yl)methyl]-1-benzofuran-3-carboxamide

IUPAC name

N-(3-chloro-2-methylphenyl)-5-hydroxy-2-methyl-4-[(morpholin-4-yl)methyl]-1-benzofuran-3-carboxamide

SMILES

Cc1c(C(Nc2cccc(Cl)c2C)=O)c2c(CN3CCOCC3)c(O)ccc2o1

InChI

InChI=1S/C22H23ClN2O4/c1-13-16(23)4-3-5-17(13)24-22(27)20-14(2)29-19-7-6-18(26)15(21(19)20)12-25-8-10-28-11-9-25/h3-7,26H,8-12H2,1-2H3,(H,24,27)

InChI Key

FIDMNPKVORULAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08143207

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.89

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.111

Distribution Coefficient, logD

4.100

Water Solubility, LogSw

-4.29

Polar Surface Area

58.768

Acid Dissociation Constant (pKa)

10.10

Base Dissociation Constant (pKb)

5.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

D089-0415 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D089-0415 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D089-0415?
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What is the minimum amount of D089-0415 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D089-0415
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D089-0415
  • 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 D089-0415 available by request