Y040-4649 Screening compound: N-(1H-INDOL-6-YL)-4-[(4-METHOXYBENZENESULFONAMIDO)METHYL]BENZAMIDE

Y040-4649 Screening compound: N-(1H-INDOL-6-YL)-4-[(4-METHOXYBENZENESULFONAMIDO)METHYL]BENZAMIDE
Y040-4649 Screening compound: N-(1H-INDOL-6-YL)-4-[(4-METHOXYBENZENESULFONAMIDO)METHYL]BENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4649
N-(1H-INDOL-6-YL)-4-[(4-METHOXYBENZENESULFONAMIDO)METHYL]BENZAMIDE

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

Y040-4649

Molecular Formula

C23H21N3O4S (C23 H21 N3 O4 S)

Compound Name

N-(1H-INDOL-6-YL)-4-[(4-METHOXYBENZENESULFONAMIDO)METHYL]BENZAMIDE

IUPAC name

n/a

SMILES

COc(cc1)ccc1S(NCc(cc1)ccc1C(Nc1cc([nH]cc2)c2cc1)=O)(=O)=O

InChI

InChI=1S/C23H21N3O4S/c1-30-20-8-10-21(11-9-20)31(28,29)25-15-16-2-4-18(5-3-16)23(27)26-19-7-6-17-12-13-24-22(17)14-19/h2-14,24-25H,15H2,1H3,(H,26,27)

InChI Key

BSEJCRKKPCZMEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12203349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.006

Distribution Coefficient, logD

4.006

Water Solubility, LogSw

-4.37

Polar Surface Area

82.413

Acid Dissociation Constant (pKa)

10.69

Base Dissociation Constant (pKb)

-2.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

Y040-4649 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with Y040-4649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4649?
Check Price and Availability of Y040-4649, 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 Y040-4649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4649
  • 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 Y040-4649 available by request