D179-0199 Screening compound: 6-{[4-(dimethylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}pyridazin-3-ol

D179-0199 Screening compound: 6-{[4-(dimethylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}pyridazin-3-ol
D179-0199 Screening compound: 6-{[4-(dimethylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}pyridazin-3-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D179-0199
6-{[4-(dimethylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}pyridazin-3-ol

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

D179-0199

Molecular Formula

C13H17N7O2 (C13 H17 N7 O2)

Compound Name

6-{[4-(dimethylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]oxy}pyridazin-3-ol

IUPAC name

6-{[4-(dimethylamino)-6-(pyrrolidin-1-yl)-135-triazin-2-yl]oxy}pyridazin-3-ol

SMILES

CN(C)c1nc(Oc(cc2)nnc2O)nc(N2CCCC2)n1

InChI

InChI=1S/C13H17N7O2/c1-19(2)11-14-12(20-7-3-4-8-20)16-13(15-11)22-10-6-5-9(21)17-18-10/h5-6H,3-4,7-8H2,1-2H3,(H,17,21)

InChI Key

JBIZHCBWPDWARF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07394714

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.089

Distribution Coefficient, logD

1.699

Water Solubility, LogSw

-2.30

Polar Surface Area

80.033

Acid Dissociation Constant (pKa)

7.24

Base Dissociation Constant (pKb)

2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

D179-0199 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D179-0199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D179-0199?
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What is the minimum amount of D179-0199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D179-0199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D179-0199
  • 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 D179-0199 available by request