0251-0245 Screening compound: bis(propan-2-yl) [(2-hydroxynaphthalen-1-yl)[(naphthalen-2-yl)amino]methyl]phosphonate

0251-0245 Screening compound: bis(propan-2-yl) [(2-hydroxynaphthalen-1-yl)[(naphthalen-2-yl)amino]methyl]phosphonate
0251-0245 Screening compound: bis(propan-2-yl) [(2-hydroxynaphthalen-1-yl)[(naphthalen-2-yl)amino]methyl]phosphonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0251-0245
bis(propan-2-yl) [(2-hydroxynaphthalen-1-yl)[(naphthalen-2-yl)amino]methyl]phosphonate

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

0251-0245

Molecular Formula

C27H30NO4P (C27 H30 NO4 P)

Compound Name

bis(propan-2-yl) [(2-hydroxynaphthalen-1-yl)[(naphthalen-2-yl)amino]methyl]phosphonate

IUPAC name

bis(propan-2-yl) [(2-hydroxynaphthalen-1-yl)[(naphthalen-2-yl)amino]methyl]phosphonate

SMILES

CC(C)OP(C(c(c1ccccc1cc1)c1O)Nc1cc2ccccc2cc1)(OC(C)C)=O

InChI

InChI=1S/C27H30NO4P/c1-18(2)31-33(30,32-19(3)4)27(26-24-12-8-7-10-21(24)14-16-25(26)29)28-23-15-13-20-9-5-6-11-22(20)17-23/h5-19,27-29H,1-4H3/t27-/m0/s1

InChI Key

QFBHUXCMBORVDD-MHZLTWQESA-N

MDL Number (MFCD)

MFCD00505834

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.302

Distribution Coefficient, logD

6.301

Water Solubility, LogSw

-6.76

Polar Surface Area

56.234

Acid Dissociation Constant (pKa)

10.13

Base Dissociation Constant (pKb)

-0.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with 0251-0245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0251-0245?
Check Price and Availability of 0251-0245, 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 0251-0245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0251-0245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0251-0245
  • 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 0251-0245 available by request