SC43-0121 Screening compound: 5-{[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undec-9-yl]sulfonyl}-1-methyl-1,3-dihydro-2H-indol-2-one

SC43-0121 Screening compound: 5-{[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undec-9-yl]sulfonyl}-1-methyl-1,3-dihydro-2H-indol-2-one
SC43-0121 Screening compound: 5-{[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undec-9-yl]sulfonyl}-1-methyl-1,3-dihydro-2H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SC43-0121
5-{[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undec-9-yl]sulfonyl}-1-methyl-1,3-dihydro-2H-indol-2-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

SC43-0121

Molecular Formula

C20H28N2O6S (C20 H28 N2 O6 S)

Compound Name

5-{[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undec-9-yl]sulfonyl}-1-methyl-1,3-dihydro-2H-indol-2-one

IUPAC name

5-{[4-(2-hydroxyethoxy)-1-oxa-9-azaspiro[5.5]undecan-9-yl]sulfonyl}-1-methyl-23-dihydro-1H-indol-2-one

SMILES

CN(C(C1)=O)c(cc2)c1cc2S(N(CC1)CCC1(C1)OCCC1OCCO)(=O)=O

InChI

InChI=1S/C20H28N2O6S/c1-21-18-3-2-17(12-15(18)13-19(21)24)29(25,26)22-7-5-20(6-8-22)14-16(4-10-28-20)27-11-9-23/h2-3,12,16,23H,4-11,13-14H2,1H3/t16-/m1/s1

InChI Key

XGBKPTKHGIWNLC-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD32258511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.460

Distribution Coefficient, logD

0.460

Water Solubility, LogSw

-2.24

Polar Surface Area

77.922

Acid Dissociation Constant (pKa)

11.20

Base Dissociation Constant (pKb)

-3.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

65.00

SC43-0121 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 SC43-0121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC43-0121?
Check Price and Availability of SC43-0121, 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 SC43-0121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC43-0121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC43-0121
  • 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 SC43-0121 available by request