G305-0749 Screening compound: 2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)acetamide

G305-0749 Screening compound: 2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)acetamide
G305-0749 Screening compound: 2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G305-0749
2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)acetamide

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

G305-0749

Molecular Formula

C24H28ClN3O3 (C24 H28 ClN3 O3)

Compound Name

2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-({1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl}methyl)acetamide

IUPAC name

2-(6-chloro-2-oxo-23-dihydro-13-benzoxazol-3-yl)-N-({1-[(25-dimethylphenyl)methyl]piperidin-4-yl}methyl)acetamide

SMILES

Cc1cc(CN2CCC(CNC(CN(c(ccc(Cl)c3)c3O3)C3=O)=O)CC2)c(C)cc1

InChI

InChI=1S/C24H28ClN3O3/c1-16-3-4-17(2)19(11-16)14-27-9-7-18(8-10-27)13-26-23(29)15-28-21-6-5-20(25)12-22(21)31-24(28)30/h3-6,11-12,18H,7-10,13-15H2,1-2H3,(H,26,29)

InChI Key

SJLUVFIKHJCHIC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14996097

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.764

Distribution Coefficient, logD

2.487

Water Solubility, LogSw

-4.73

Polar Surface Area

51.271

Acid Dissociation Constant (pKa)

14.85

Base Dissociation Constant (pKb)

9.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

G305-0749 in Drug Discovery

Included in Screening Libraries

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

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G305-0749 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G305-0749?
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What is the minimum amount of G305-0749 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G305-0749
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G305-0749
  • 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 G305-0749 available by request