Y050-3137 Screening compound: 1-benzoyl-N-(3-methoxyphenyl)-2,3-dihydro-1H-indole-5-sulfonamide

Y050-3137 Screening compound: 1-benzoyl-N-(3-methoxyphenyl)-2,3-dihydro-1H-indole-5-sulfonamide
Y050-3137 Screening compound: 1-benzoyl-N-(3-methoxyphenyl)-2,3-dihydro-1H-indole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-3137
1-benzoyl-N-(3-methoxyphenyl)-2,3-dihydro-1H-indole-5-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

Y050-3137

Molecular Formula

C22H20N2O4S (C22 H20 N2 O4 S)

Compound Name

1-benzoyl-N-(3-methoxyphenyl)-2,3-dihydro-1H-indole-5-sulfonamide

IUPAC name

1-benzoyl-N-(3-methoxyphenyl)-23-dihydro-1H-indole-5-sulfonamide

SMILES

COc1cccc(NS(c(cc2)cc(CC3)c2N3C(c2ccccc2)=O)(=O)=O)c1

InChI

InChI=1S/C22H20N2O4S/c1-28-19-9-5-8-18(15-19)23-29(26,27)20-10-11-21-17(14-20)12-13-24(21)22(25)16-6-3-2-4-7-16/h2-11,14-15,23H,12-13H2,1H3

InChI Key

QQMZUTUBSCFJTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11851472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.781

Distribution Coefficient, logD

3.760

Water Solubility, LogSw

-4.04

Polar Surface Area

64.111

Acid Dissociation Constant (pKa)

8.70

Base Dissociation Constant (pKb)

-4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

Y050-3137 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with Y050-3137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-3137?
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What is the minimum amount of Y050-3137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-3137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-3137
  • 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 Y050-3137 available by request