6178-0033 Screening compound: N-[4-(dimethylamino)phenyl]-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide

6178-0033 Screening compound: N-[4-(dimethylamino)phenyl]-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide
6178-0033 Screening compound: N-[4-(dimethylamino)phenyl]-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6178-0033
N-[4-(dimethylamino)phenyl]-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-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

6178-0033

Molecular Formula

C15H20N4O2S (C15 H20 N4 O2 S)

Compound Name

N-[4-(dimethylamino)phenyl]-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide

IUPAC name

N-[4-(dimethylamino)phenyl]-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-13-thiazolidin-5-yl]acetamide

SMILES

CN(C)c(cc1)ccc1NC(CC(C(N1C)=O)S/C1=N\C)=O

InChI

InChI=1S/C15H20N4O2S/c1-16-15-19(4)14(21)12(22-15)9-13(20)17-10-5-7-11(8-6-10)18(2)3/h5-8,12H,9H2,1-4H3,(H,17,20)/t12-/m0/s1

InChI Key

JIOBBHALQVZNCZ-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD03786867

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.527

Distribution Coefficient, logD

1.518

Water Solubility, LogSw

-2.40

Polar Surface Area

53.880

Acid Dissociation Constant (pKa)

12.01

Base Dissociation Constant (pKb)

9.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

6178-0033 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6178-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6178-0033?
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What is the minimum amount of 6178-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6178-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6178-0033
  • 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 6178-0033 available by request