1778-2904 Screening compound: ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]formamido}acetate

1778-2904 Screening compound: ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]formamido}acetate
1778-2904 Screening compound: ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]formamido}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1778-2904
ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]formamido}acetate

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

1778-2904

Molecular Formula

C15H14Cl2N2O4 (C15 H14 Cl2 N2 O4)

Compound Name

ethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]formamido}acetate

IUPAC name

ethyl 2-{[3-(26-dichlorophenyl)-5-methyl-12-oxazol-4-yl]formamido}acetate

SMILES

CCOC(CNC(c1c(C)onc1-c(c(Cl)ccc1)c1Cl)=O)=O

InChI

InChI=1S/C15H14Cl2N2O4/c1-3-22-11(20)7-18-15(21)12-8(2)23-19-14(12)13-9(16)5-4-6-10(13)17/h4-6H,3,7H2,1-2H3,(H,18,21)

InChI Key

IRNLJZHMQCRIIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00275590

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.19

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.524

Distribution Coefficient, logD

2.523

Water Solubility, LogSw

-3.41

Polar Surface Area

67.042

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-4.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

1778-2904 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1778-2904 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1778-2904?
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What is the minimum amount of 1778-2904 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1778-2904
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1778-2904
  • 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 1778-2904 available by request