Y030-7998 Screening compound: 2-(2,4-dichlorophenoxy)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide

Y030-7998 Screening compound: 2-(2,4-dichlorophenoxy)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide
Y030-7998 Screening compound: 2-(2,4-dichlorophenoxy)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-7998
2-(2,4-dichlorophenoxy)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-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

Y030-7998

Molecular Formula

C14H15Cl2N3O2S (C14 H15 Cl2 N3 O2 S)

Compound Name

2-(2,4-dichlorophenoxy)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide

IUPAC name

2-(24-dichlorophenoxy)-N-[5-(2-methylpropyl)-134-thiadiazol-2-yl]acetamide

SMILES

CC(C)Cc1nnc(NC(COc(ccc(Cl)c2)c2Cl)=O)s1

InChI

InChI=1S/C14H15Cl2N3O2S/c1-8(2)5-13-18-19-14(22-13)17-12(20)7-21-11-4-3-9(15)6-10(11)16/h3-4,6,8H,5,7H2,1-2H3,(H,17,19,20)

InChI Key

WJTDYLGAOMQWOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01043948

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.26

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.503

Distribution Coefficient, logD

4.439

Water Solubility, LogSw

-4.53

Polar Surface Area

54.742

Acid Dissociation Constant (pKa)

8.20

Base Dissociation Constant (pKb)

-3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

Y030-7998 in Drug Discovery

Included in Screening Libraries

Human Ion Channels Annotated Library (353 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y030-7998 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-7998?
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What is the minimum amount of Y030-7998 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-7998
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-7998
  • 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 Y030-7998 available by request