6577-0577 Screening compound: 7-(tert-butyl)-2-hydroxy-4-phenyl-2H-1,2lambda~5~-benzoxaphosphinin-2-one

6577-0577 Screening compound: 7-(tert-butyl)-2-hydroxy-4-phenyl-2H-1,2lambda~5~-benzoxaphosphinin-2-one
6577-0577 Screening compound: 7-(tert-butyl)-2-hydroxy-4-phenyl-2H-1,2lambda~5~-benzoxaphosphinin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6577-0577
7-(tert-butyl)-2-hydroxy-4-phenyl-2H-1,2lambda~5~-benzoxaphosphinin-2-one

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

6577-0577

Molecular Formula

C18H19O3P (C18 H19 O3 P)

Compound Name

7-(tert-butyl)-2-hydroxy-4-phenyl-2H-1,2lambda~5~-benzoxaphosphinin-2-one

IUPAC name

7-tert-butyl-2-hydroxy-4-phenyl-2H-12lambda5-benzoxaphosphinin-2-one

SMILES

CC(C)(C)c(cc1)cc(O2)c1C(c1ccccc1)=CP2(O)=O

InChI

InChI=1S/C18H19O3P/c1-18(2,3)14-9-10-15-16(13-7-5-4-6-8-13)12-22(19,20)21-17(15)11-14/h4-12H,1-3H3,(H,19,20)

InChI Key

PFRAHCGTJFNVCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14711785

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.907

Distribution Coefficient, logD

-1.992

Water Solubility, LogSw

-4.19

Polar Surface Area

43.219

Acid Dissociation Constant (pKa)

1.50

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

6577-0577 in Drug Discovery

Included in Screening Libraries

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 6577-0577 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6577-0577?
Check Price and Availability of 6577-0577, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6577-0577 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6577-0577
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6577-0577
  • 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 6577-0577 available by request