1153-0092 Screening compound: N-{2-[(2,4-dichlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamide

1153-0092 Screening compound: N-{2-[(2,4-dichlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamide
1153-0092 Screening compound: N-{2-[(2,4-dichlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1153-0092
N-{2-[(2,4-dichlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}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

1153-0092

Molecular Formula

C15H19Cl2NO6 (C15 H19 Cl2 NO6)

Compound Name

N-{2-[(2,4-dichlorophenyl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamide

IUPAC name

N-{2-[(24-dichlorophenyl)methoxy]-45-dihydroxy-6-(hydroxymethyl)oxan-3-yl}acetamide

SMILES

CC(NC(C1O)C(OCc(ccc(Cl)c2)c2Cl)OC(CO)C1O)=O

InChI

InChI=1S/C15H19Cl2NO6/c1-7(20)18-12-14(22)13(21)11(5-19)24-15(12)23-6-8-2-3-9(16)4-10(8)17/h2-4,11-15,19,21-22H,5-6H2,1H3,(H,18,20)

InChI Key

CIHDSPCYFDFWRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01118859

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.22

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.169

Distribution Coefficient, logD

1.169

Water Solubility, LogSw

-2.23

Polar Surface Area

89.964

Acid Dissociation Constant (pKa)

13.34

Base Dissociation Constant (pKb)

-1.44

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

53.30

1153-0092 in Drug Discovery

Included in Screening Libraries

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

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 1153-0092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1153-0092?
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What is the minimum amount of 1153-0092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1153-0092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1153-0092
  • 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 1153-0092 available by request