Y040-0919 Screening compound: 2-(2-chlorophenyl)-N~5~-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-4-methyl-1,3-thiazole-5-carboxamide

Y040-0919 Screening compound: 2-(2-chlorophenyl)-N~5~-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-4-methyl-1,3-thiazole-5-carboxamide
Y040-0919 Screening compound: 2-(2-chlorophenyl)-N~5~-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-4-methyl-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-0919
2-(2-chlorophenyl)-N~5~-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-4-methyl-1,3-thiazole-5-carboxamide

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

Y040-0919

Molecular Formula

C16H19ClN2O2S (C16 H19 ClN2 O2 S)

Compound Name

2-(2-chlorophenyl)-N~5~-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-4-methyl-1,3-thiazole-5-carboxamide

IUPAC name

2-(2-chlorophenyl)-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4-methyl-13-thiazole-5-carboxamide

SMILES

CC(C)C(CO)NC(c1c(C)nc(-c(cccc2)c2Cl)s1)=O

InChI

InChI=1S/C16H19ClN2O2S/c1-9(2)13(8-20)19-15(21)14-10(3)18-16(22-14)11-6-4-5-7-12(11)17/h4-7,9,13,20H,8H2,1-3H3,(H,19,21)/t13-/m0/s1

InChI Key

LNBQJBOSNZTSHB-ZDUSSCGKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.86

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.871

Distribution Coefficient, logD

3.871

Water Solubility, LogSw

-4.07

Polar Surface Area

51.980

Acid Dissociation Constant (pKa)

15.10

Base Dissociation Constant (pKb)

0.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with Y040-0919 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-0919?
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What is the minimum amount of Y040-0919 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-0919
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-0919
  • 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 Y040-0919 available by request