D183-0089 Screening compound: 3-(2-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}ethyl)-1-(4-chlorophenyl)urea

D183-0089 Screening compound: 3-(2-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}ethyl)-1-(4-chlorophenyl)urea
D183-0089 Screening compound: 3-(2-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}ethyl)-1-(4-chlorophenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound D183-0089
3-(2-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}ethyl)-1-(4-chlorophenyl)urea

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

D183-0089

Molecular Formula

C16H22ClN7O2 (C16 H22 ClN7 O2)

Compound Name

3-(2-{[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]oxy}ethyl)-1-(4-chlorophenyl)urea

IUPAC name

3-(2-{[46-bis(dimethylamino)-135-triazin-2-yl]oxy}ethyl)-1-(4-chlorophenyl)urea

SMILES

CN(C)c1nc(OCCNC(Nc(cc2)ccc2Cl)=O)nc(N(C)C)n1

InChI

InChI=1S/C16H22ClN7O2/c1-23(2)13-20-14(24(3)4)22-16(21-13)26-10-9-18-15(25)19-12-7-5-11(17)6-8-12/h5-8H,9-10H2,1-4H3,(H2,18,19,25)

InChI Key

LSELVNBHSRRGND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06177803

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.85

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.895

Distribution Coefficient, logD

3.895

Water Solubility, LogSw

-4.47

Polar Surface Area

74.253

Acid Dissociation Constant (pKa)

12.02

Base Dissociation Constant (pKb)

2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

D183-0089 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with D183-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D183-0089?
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What is the minimum amount of D183-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D183-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D183-0089
  • 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 D183-0089 available by request