0358-0037 Screening compound: 3-{[2-(dodecyloxy)-2-oxoethyl]carbamoyl}-2-sulfonatopropanoate

0358-0037 Screening compound: 3-{[2-(dodecyloxy)-2-oxoethyl]carbamoyl}-2-sulfonatopropanoate
0358-0037 Screening compound: 3-{[2-(dodecyloxy)-2-oxoethyl]carbamoyl}-2-sulfonatopropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0358-0037
3-{[2-(dodecyloxy)-2-oxoethyl]carbamoyl}-2-sulfonatopropanoate

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

0358-0037

Molecular Formula

C18H31NO8S (C18 H31 NO8 S)

Compound Name

3-{[2-(dodecyloxy)-2-oxoethyl]carbamoyl}-2-sulfonatopropanoate

IUPAC name

3-{[2-(dodecyloxy)-2-oxoethyl]carbamoyl}-2-sulfonatopropanoate

SMILES

CCCCCCCCCCCCOC(CNC(CC(C([O-])=O)S([O-])(=O)=O)=O)=O

InChI

InChI=1S/C18H33NO8S/c1-2-3-4-5-6-7-8-9-10-11-12-27-17(21)14-19-16(20)13-15(18(22)23)28(24,25)26/h15H,2-14H2,1H3,(H,19,20)(H,22,23)(H,24,25,26)/p-2/t15-/m0/s1

InChI Key

SLCFKMBFDGWMLZ-HNNXBMFYSA-L

MDL Number (MFCD)

MFCD00985377

Chemical and Physical Properties

Saltdata

2Na+

Molecular Weight

421.51

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

19.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.976

Distribution Coefficient, logD

1.976

Water Solubility, LogSw

-2.33

Polar Surface Area

116.256

Acid Dissociation Constant (pKa)

13.22

Base Dissociation Constant (pKb)

-3.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

83.30

References: we are preparing a list of scientific research reports with 0358-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0358-0037?
Check Price and Availability of 0358-0037, 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 0358-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0358-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0358-0037
  • 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 0358-0037 available by request