1431-0326 Screening compound: 4-(4-tert-butylbenzenesulfonyl)morpholine

1431-0326 Screening compound: 4-(4-tert-butylbenzenesulfonyl)morpholine
1431-0326 Screening compound: 4-(4-tert-butylbenzenesulfonyl)morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1431-0326
4-(4-tert-butylbenzenesulfonyl)morpholine

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

1431-0326

Molecular Formula

C14H21NO3S (C14 H21 NO3 S)

Compound Name

4-(4-tert-butylbenzenesulfonyl)morpholine

IUPAC name

4-(4-tert-butylbenzenesulfonyl)morpholine

SMILES

CC(C)(C)c(cc1)ccc1S(N1CCOCC1)(=O)=O

InChI

InChI=1S/C14H21NO3S/c1-14(2,3)12-4-6-13(7-5-12)19(16,17)15-8-10-18-11-9-15/h4-7H,8-11H2,1-3H3

InChI Key

XONDHDLFWMNULS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00980549

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.092

Distribution Coefficient, logD

3.092

Water Solubility, LogSw

-3.17

Polar Surface Area

39.858

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-5.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

1431-0326 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
  • Pool

References: we are preparing a list of scientific research reports with 1431-0326 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1431-0326?
Check Price and Availability of 1431-0326, 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 1431-0326 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1431-0326
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1431-0326
  • 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 1431-0326 available by request