1683-6563 Screening compound: propan-2-yl 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]propanoate

1683-6563 Screening compound: propan-2-yl 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]propanoate
1683-6563 Screening compound: propan-2-yl 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1683-6563
propan-2-yl 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]propanoate

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

1683-6563

Molecular Formula

C9H14N4O4 (C9 H14 N4 O4)

Compound Name

propan-2-yl 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]propanoate

IUPAC name

propan-2-yl 3-[(35-dioxo-2345-tetrahydro-124-triazin-6-yl)amino]propanoate

SMILES

CC(C)OC(CCNC(C(N1)=O)=NNC1=O)=O

InChI

InChI=1S/C9H14N4O4/c1-5(2)17-6(14)3-4-10-7-8(15)11-9(16)13-12-7/h5H,3-4H2,1-2H3,(H,10,12)(H2,11,13,15,16)

InChI Key

QEECNHRKBOSUAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00790582

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

242.23

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.796

Distribution Coefficient, logD

-2.460

Water Solubility, LogSw

-1.08

Polar Surface Area

92.664

Acid Dissociation Constant (pKa)

5.75

Base Dissociation Constant (pKb)

3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

1683-6563 in Drug Discovery

Included in Screening Libraries

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1683-6563 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1683-6563?
Check Price and Availability of 1683-6563, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 1683-6563 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1683-6563
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1683-6563
  • 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 1683-6563 available by request