C153-0556 Screening compound: 4-{[3-methyl-2-(morpholine-4-carbonyl)-1-benzofuran-5-yl]sulfonyl}morpholine

C153-0556 Screening compound: 4-{[3-methyl-2-(morpholine-4-carbonyl)-1-benzofuran-5-yl]sulfonyl}morpholine
C153-0556 Screening compound: 4-{[3-methyl-2-(morpholine-4-carbonyl)-1-benzofuran-5-yl]sulfonyl}morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound C153-0556
4-{[3-methyl-2-(morpholine-4-carbonyl)-1-benzofuran-5-yl]sulfonyl}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

C153-0556

Molecular Formula

C18H22N2O6S (C18 H22 N2 O6 S)

Compound Name

4-{[3-methyl-2-(morpholine-4-carbonyl)-1-benzofuran-5-yl]sulfonyl}morpholine

IUPAC name

4-{[3-methyl-2-(morpholine-4-carbonyl)-1-benzofuran-5-yl]sulfonyl}morpholine

SMILES

Cc1c(C(N2CCOCC2)=O)oc(cc2)c1cc2S(N1CCOCC1)(=O)=O

InChI

InChI=1S/C18H22N2O6S/c1-13-15-12-14(27(22,23)20-6-10-25-11-7-20)2-3-16(15)26-17(13)18(21)19-4-8-24-9-5-19/h2-3,12H,4-11H2,1H3

InChI Key

MKZXMTAPWSJEFC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05029278

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.459

Distribution Coefficient, logD

1.459

Water Solubility, LogSw

-2.47

Polar Surface Area

72.941

Acid Dissociation Constant (pKa)

27.55

Base Dissociation Constant (pKb)

-1.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C153-0556 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C153-0556 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C153-0556?
Check Price and Availability of C153-0556, 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 C153-0556 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C153-0556
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C153-0556
  • 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 C153-0556 available by request