4912-1257 Screening compound: 1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl diphenyl phosphate

4912-1257 Screening compound: 1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl diphenyl phosphate
4912-1257 Screening compound: 1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl diphenyl phosphate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4912-1257
1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl diphenyl phosphate

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

4912-1257

Molecular Formula

C16H17O6PS (C16 H17 O6 PS)

Compound Name

1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl diphenyl phosphate

IUPAC name

11-dioxo-1lambda6-thiolan-3-yl diphenyl phosphate

SMILES

O=P(OC(CC1)CS1(=O)=O)(Oc1ccccc1)Oc1ccccc1

InChI

InChI=1S/C16H17O6PS/c17-23(20-14-7-3-1-4-8-14,21-15-9-5-2-6-10-15)22-16-11-12-24(18,19)13-16/h1-10,16H,11-13H2/t16-/m1/s1

InChI Key

DPFVSVOPPSKBDO-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD00188772

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.623

Distribution Coefficient, logD

1.623

Water Solubility, LogSw

-2.03

Polar Surface Area

65.702

Acid Dissociation Constant (pKa)

20.41

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 4912-1257 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4912-1257?
Check Price and Availability of 4912-1257, 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 4912-1257 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4912-1257
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4912-1257
  • 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 4912-1257 available by request