0149-0080 Screening compound: 4,8-di(tert-butyl)-2,10-dimethyl-12H-6lambda~5~-dibenzo[d,g][1,3,2]dioxaphosphocin-6-one

0149-0080 Screening compound: 4,8-di(tert-butyl)-2,10-dimethyl-12H-6lambda~5~-dibenzo[d,g][1,3,2]dioxaphosphocin-6-one
0149-0080 Screening compound: 4,8-di(tert-butyl)-2,10-dimethyl-12H-6lambda~5~-dibenzo[d,g][1,3,2]dioxaphosphocin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0149-0080
4,8-di(tert-butyl)-2,10-dimethyl-12H-6lambda~5~-dibenzo[d,g][1,3,2]dioxaphosphocin-6-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

0149-0080

Molecular Formula

C23H30O3P (C23 H30 O3 P)

Compound Name

4,8-di(tert-butyl)-2,10-dimethyl-12H-6lambda~5~-dibenzo[d,g][1,3,2]dioxaphosphocin-6-one

IUPAC name

713-di-tert-butyl-515-dimethyl-911-dioxa-10lambda5-phosphatricyclo[10.4.0.0^{38}]hexadeca-1(12)3571315-hexaen-10-one

SMILES

CC(C)(C)c(cc(C)cc1Cc2cc(C)cc(C(C)(C)C)c2O2)c1OP2=O

InChI

InChI=1S/C23H31O3P/c1-14-9-16-13-17-10-15(2)12-19(23(6,7)8)21(17)26-27(24)25-20(16)18(11-14)22(3,4)5/h9-12,27H,13H2,1-8H3

InChI Key

LVDRGWMJYXZLDB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00355529

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.294

Distribution Coefficient, logD

6.294

Water Solubility, LogSw

-5.61

Polar Surface Area

31.314

Acid Dissociation Constant (pKa)

26.93

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

References: we are preparing a list of scientific research reports with 0149-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0149-0080?
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What is the minimum amount of 0149-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0149-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0149-0080
  • 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 0149-0080 available by request