D272-0884 Screening compound: 5-[({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methyl)amino]-2,3-dihydro-1H-1,3-benzodiazol-2-one

D272-0884 Screening compound: 5-[({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methyl)amino]-2,3-dihydro-1H-1,3-benzodiazol-2-one
D272-0884 Screening compound: 5-[({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methyl)amino]-2,3-dihydro-1H-1,3-benzodiazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D272-0884
5-[({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methyl)amino]-2,3-dihydro-1H-1,3-benzodiazol-2-one

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

D272-0884

Molecular Formula

C23H23N3O3 (C23 H23 N3 O3)

Compound Name

5-[({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methyl)amino]-2,3-dihydro-1H-1,3-benzodiazol-2-one

IUPAC name

5-[({3-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methyl)amino]-23-dihydro-1H-13-benzodiazol-2-one

SMILES

Cc1cccc(COc(ccc(CNc(cc2)cc(N3)c2NC3=O)c2)c2OC)c1

InChI

InChI=1S/C23H23N3O3/c1-15-4-3-5-17(10-15)14-29-21-9-6-16(11-22(21)28-2)13-24-18-7-8-19-20(12-18)26-23(27)25-19/h3-12,24H,13-14H2,1-2H3,(H2,25,26,27)

InChI Key

GTSZTXYJZFREKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07434405

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.182

Distribution Coefficient, logD

4.182

Water Solubility, LogSw

-4.54

Polar Surface Area

61.144

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

4.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

D272-0884 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D272-0884 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D272-0884?
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What is the minimum amount of D272-0884 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D272-0884
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D272-0884
  • 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 D272-0884 available by request