Y070-1169 Screening compound: 2-(2-methoxyphenoxy)-N-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]acetamide

Y070-1169 Screening compound: 2-(2-methoxyphenoxy)-N-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]acetamide
Y070-1169 Screening compound: 2-(2-methoxyphenoxy)-N-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-1169
2-(2-methoxyphenoxy)-N-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]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

Y070-1169

Molecular Formula

C18H15N3O7S2 (C18 H15 N3 O7 S2)

Compound Name

2-(2-methoxyphenoxy)-N-[5-(4-nitrobenzenesulfonyl)-1,3-thiazol-2-yl]acetamide

IUPAC name

2-(2-methoxyphenoxy)-N-[5-(4-nitrobenzenesulfonyl)-13-thiazol-2-yl]acetamide

SMILES

COc(cccc1)c1OCC(Nc(s1)ncc1S(c(cc1)ccc1[N+]([O-])=O)(=O)=O)=O

InChI

InChI=1S/C18H15N3O7S2/c1-27-14-4-2-3-5-15(14)28-11-16(22)20-18-19-10-17(29-18)30(25,26)13-8-6-12(7-9-13)21(23)24/h2-10H,11H2,1H3,(H,19,20,22)

InChI Key

NPXPMWIOHJQLSB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03463687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.47

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.233

Distribution Coefficient, logD

3.228

Water Solubility, LogSw

-3.72

Polar Surface Area

111.783

Acid Dissociation Constant (pKa)

9.35

Base Dissociation Constant (pKb)

-5.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

Y070-1169 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y070-1169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-1169?
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What is the minimum amount of Y070-1169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-1169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-1169
  • 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 Y070-1169 available by request