0318-0171 Screening compound: 1-(2,2-dichloro-1-hydroxyethyl)-3,3-dimethylurea

0318-0171 Screening compound: 1-(2,2-dichloro-1-hydroxyethyl)-3,3-dimethylurea
0318-0171 Screening compound: 1-(2,2-dichloro-1-hydroxyethyl)-3,3-dimethylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound 0318-0171
1-(2,2-dichloro-1-hydroxyethyl)-3,3-dimethylurea

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

0318-0171

Molecular Formula

C5H10Cl2N2O2 (C5 H10 Cl2 N2 O2)

Compound Name

1-(2,2-dichloro-1-hydroxyethyl)-3,3-dimethylurea

IUPAC name

1-(22-dichloro-1-hydroxyethyl)-33-dimethylurea

SMILES

CN(C)C(NC(C(Cl)Cl)O)=O

InChI

InChI=1S/C5H10Cl2N2O2/c1-9(2)5(11)8-4(10)3(6)7/h3-4,10H,1-2H3,(H,8,11)/t4-/m0/s1

InChI Key

YATSNJLSINKZLL-BYPYZUCNSA-N

MDL Number (MFCD)

MFCD00181941

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

201.05

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.019

Distribution Coefficient, logD

0.019

Water Solubility, LogSw

-0.95

Polar Surface Area

43.834

Acid Dissociation Constant (pKa)

12.28

Base Dissociation Constant (pKb)

-0.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

80.00

0318-0171 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0318-0171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0318-0171?
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What is the minimum amount of 0318-0171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0318-0171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0318-0171
  • 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 0318-0171 available by request