Y050-1706 Screening compound: 2-(N-methyl3-chloro-4-ethoxybenzenesulfonamido)-N-[(oxolan-2-yl)methyl]acetamide

Y050-1706 Screening compound: 2-(N-methyl3-chloro-4-ethoxybenzenesulfonamido)-N-[(oxolan-2-yl)methyl]acetamide
Y050-1706 Screening compound: 2-(N-methyl3-chloro-4-ethoxybenzenesulfonamido)-N-[(oxolan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-1706
2-(N-methyl3-chloro-4-ethoxybenzenesulfonamido)-N-[(oxolan-2-yl)methyl]acetamide

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

Y050-1706

Molecular Formula

C16H23ClN2O5S (C16 H23 ClN2 O5 S)

Compound Name

2-(N-methyl3-chloro-4-ethoxybenzenesulfonamido)-N-[(oxolan-2-yl)methyl]acetamide

IUPAC name

2-(N-methyl3-chloro-4-ethoxybenzenesulfonamido)-N-[(oxolan-2-yl)methyl]acetamide

SMILES

CCOc(ccc(S(N(C)CC(NCC1OCCC1)=O)(=O)=O)c1)c1Cl

InChI

InChI=1S/C16H23ClN2O5S/c1-3-23-15-7-6-13(9-14(15)17)25(21,22)19(2)11-16(20)18-10-12-5-4-8-24-12/h6-7,9,12H,3-5,8,10-11H2,1-2H3,(H,18,20)/t12-/m1/s1

InChI Key

GQSORBPNNADTQX-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD07396428

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.89

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.264

Distribution Coefficient, logD

1.264

Water Solubility, LogSw

-2.96

Polar Surface Area

73.139

Acid Dissociation Constant (pKa)

13.50

Base Dissociation Constant (pKb)

-1.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.30

Y050-1706 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y050-1706 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-1706?
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What is the minimum amount of Y050-1706 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-1706
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-1706
  • 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 Y050-1706 available by request