1187-1079 Screening compound: ethyl [5-(benzylamino)-2-(4-chlorophenyl)-1,3-oxazol-4-yl](phenyl)phosphinate

1187-1079 Screening compound: ethyl [5-(benzylamino)-2-(4-chlorophenyl)-1,3-oxazol-4-yl](phenyl)phosphinate
1187-1079 Screening compound: ethyl [5-(benzylamino)-2-(4-chlorophenyl)-1,3-oxazol-4-yl](phenyl)phosphinate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1187-1079
ethyl [5-(benzylamino)-2-(4-chlorophenyl)-1,3-oxazol-4-yl](phenyl)phosphinate

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

1187-1079

Molecular Formula

C24H22ClN2O3P (C24 H22 ClN2 O3 P)

Compound Name

ethyl [5-(benzylamino)-2-(4-chlorophenyl)-1,3-oxazol-4-yl](phenyl)phosphinate

IUPAC name

ethyl [5-(benzylamino)-2-(4-chlorophenyl)-13-oxazol-4-yl](phenyl)phosphinate

SMILES

CCOP(c1c(NCc2ccccc2)oc(-c(cc2)ccc2Cl)n1)(c1ccccc1)=O

InChI

InChI=1S/C24H22ClN2O3P/c1-2-29-31(28,21-11-7-4-8-12-21)24-23(26-17-18-9-5-3-6-10-18)30-22(27-24)19-13-15-20(25)16-14-19/h3-16,26H,2,17H2,1H3/t31-/m0/s1

InChI Key

JAXVGIGJAZXXLE-HKBQPEDESA-N

MDL Number (MFCD)

MFCD00522098

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.88

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.433

Distribution Coefficient, logD

5.433

Water Solubility, LogSw

-6.07

Polar Surface Area

50.183

Acid Dissociation Constant (pKa)

18.00

Base Dissociation Constant (pKb)

-5.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 1187-1079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1187-1079?
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What is the minimum amount of 1187-1079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1187-1079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1187-1079
  • 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 1187-1079 available by request