V024-2744 Screening compound: 2-({benzyl[(2,3-dichlorophenyl)methyl]amino}methyl)-N-ethyl-1,3-oxazole-4-carboxamide

V024-2744 Screening compound: 2-({benzyl[(2,3-dichlorophenyl)methyl]amino}methyl)-N-ethyl-1,3-oxazole-4-carboxamide
V024-2744 Screening compound: 2-({benzyl[(2,3-dichlorophenyl)methyl]amino}methyl)-N-ethyl-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-2744
2-({benzyl[(2,3-dichlorophenyl)methyl]amino}methyl)-N-ethyl-1,3-oxazole-4-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

V024-2744

Molecular Formula

C21H21Cl2N3O2 (C21 H21 Cl2 N3 O2)

Compound Name

2-({benzyl[(2,3-dichlorophenyl)methyl]amino}methyl)-N-ethyl-1,3-oxazole-4-carboxamide

IUPAC name

2-({benzyl[(23-dichlorophenyl)methyl]amino}methyl)-N-ethyl-13-oxazole-4-carboxamide

SMILES

CCNC(c1coc(CN(Cc2ccccc2)Cc2cccc(Cl)c2Cl)n1)=O

InChI

InChI=1S/C21H21Cl2N3O2/c1-2-24-21(27)18-14-28-19(25-18)13-26(11-15-7-4-3-5-8-15)12-16-9-6-10-17(22)20(16)23/h3-10,14H,2,11-13H2,1H3,(H,24,27)

InChI Key

CRVKBWSRGWQTKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19832154

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

418.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.376

Distribution Coefficient, logD

4.376

Water Solubility, LogSw

-4.44

Polar Surface Area

46.395

Acid Dissociation Constant (pKa)

14.60

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

V024-2744 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V024-2744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-2744?
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What is the minimum amount of V024-2744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-2744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-2744
  • 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 V024-2744 available by request