E667-0231 Screening compound: N-(butan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole-6-sulfonamide

E667-0231 Screening compound: N-(butan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole-6-sulfonamide
E667-0231 Screening compound: N-(butan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E667-0231
N-(butan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole-6-sulfonamide

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

E667-0231

Molecular Formula

C16H22N2O2S (C16 H22 N2 O2 S)

Compound Name

N-(butan-2-yl)-2,3,4,9-tetrahydro-1H-carbazole-6-sulfonamide

IUPAC name

N-(butan-2-yl)-2349-tetrahydro-1H-carbazole-6-sulfonamide

SMILES

CCC(C)NS(c(cc1)cc2c1[nH]c1c2CCCC1)(=O)=O

InChI

InChI=1S/C16H22N2O2S/c1-3-11(2)18-21(19,20)12-8-9-16-14(10-12)13-6-4-5-7-15(13)17-16/h8-11,17-18H,3-7H2,1-2H3/t11-/m0/s1

InChI Key

OKSXFMQJGTWHLU-NSHDSACASA-N

MDL Number (MFCD)

MFCD14908890

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.301

Distribution Coefficient, logD

3.301

Water Solubility, LogSw

-3.69

Polar Surface Area

52.694

Acid Dissociation Constant (pKa)

11.22

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

E667-0231 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with E667-0231 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E667-0231?
Check Price and Availability of E667-0231, 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 E667-0231 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E667-0231
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E667-0231
  • 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 E667-0231 available by request