6723-0049 Screening compound: ethyl 4-{[4-(dipropylamino)-6-methoxy-1,3,5-triazin-2-yl]amino}piperidine-1-carboxylate

6723-0049 Screening compound: ethyl 4-{[4-(dipropylamino)-6-methoxy-1,3,5-triazin-2-yl]amino}piperidine-1-carboxylate
6723-0049 Screening compound: ethyl 4-{[4-(dipropylamino)-6-methoxy-1,3,5-triazin-2-yl]amino}piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6723-0049
ethyl 4-{[4-(dipropylamino)-6-methoxy-1,3,5-triazin-2-yl]amino}piperidine-1-carboxylate

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

6723-0049

Molecular Formula

C18H32N6O3 (C18 H32 N6 O3)

Compound Name

ethyl 4-{[4-(dipropylamino)-6-methoxy-1,3,5-triazin-2-yl]amino}piperidine-1-carboxylate

IUPAC name

ethyl 4-{[4-(dipropylamino)-6-methoxy-135-triazin-2-yl]amino}piperidine-1-carboxylate

SMILES

CCCN(CCC)c1nc(NC(CC2)CCN2C(OCC)=O)nc(OC)n1

InChI

InChI=1S/C18H32N6O3/c1-5-10-23(11-6-2)16-20-15(21-17(22-16)26-4)19-14-8-12-24(13-9-14)18(25)27-7-3/h14H,5-13H2,1-4H3,(H,19,20,21,22)

InChI Key

IZCBEWIIEYZEJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14711917

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.452

Distribution Coefficient, logD

4.452

Water Solubility, LogSw

-4.06

Polar Surface Area

73.494

Acid Dissociation Constant (pKa)

16.61

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

77.80

6723-0049 in Drug Discovery

Included in Screening Libraries

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

Human GPCR Annotated Library (5539 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 6723-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6723-0049?
Check Price and Availability of 6723-0049, 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 6723-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6723-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6723-0049
  • 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 6723-0049 available by request