8017-4342 Screening compound: (4-fluorophenyl)(morpholino)methyl(dimorpholino)phosphine oxide

8017-4342 Screening compound: (4-fluorophenyl)(morpholino)methyl(dimorpholino)phosphine oxide
8017-4342 Screening compound: (4-fluorophenyl)(morpholino)methyl(dimorpholino)phosphine oxide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-4342
(4-fluorophenyl)(morpholino)methyl(dimorpholino)phosphine oxide

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

8017-4342

Molecular Formula

C19H29FN3O4P (C19 H29 FN3 O4 P)

Compound Name

(4-fluorophenyl)(morpholino)methyl(dimorpholino)phosphine oxide

IUPAC name

4-{[(4-fluorophenyl)(morpholin-4-yl)methyl](morpholin-4-yl)phosphoroso}morpholine

SMILES

O=P(C(c(cc1)ccc1F)N1CCOCC1)(N1CCOCC1)N1CCOCC1

InChI

InChI=1S/C19H29FN3O4P/c20-18-3-1-17(2-4-18)19(21-5-11-25-12-6-21)28(24,22-7-13-26-14-8-22)23-9-15-27-16-10-23/h1-4,19H,5-16H2/t19-/m0/s1

InChI Key

BRPSNENMJUXAIX-IBGZPJMESA-N

MDL Number (MFCD)

MFCD06016826

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.772

Distribution Coefficient, logD

0.772

Water Solubility, LogSw

-1.16

Polar Surface Area

52.156

Acid Dissociation Constant (pKa)

25.24

Base Dissociation Constant (pKb)

2.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.42

8017-4342 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8017-4342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-4342?
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What is the minimum amount of 8017-4342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-4342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-4342
  • 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 8017-4342 available by request