3132-1237 Screening compound: 2-{4-[6-amino-5-cyano-3-(methoxymethyl)-2H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenoxy}-N,N-diethylacetamide

3132-1237 Screening compound: 2-{4-[6-amino-5-cyano-3-(methoxymethyl)-2H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenoxy}-N,N-diethylacetamide
3132-1237 Screening compound: 2-{4-[6-amino-5-cyano-3-(methoxymethyl)-2H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenoxy}-N,N-diethylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3132-1237
2-{4-[6-amino-5-cyano-3-(methoxymethyl)-2H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenoxy}-N,N-diethylacetamide

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

3132-1237

Molecular Formula

C22H27N5O5 (C22 H27 N5 O5)

Compound Name

2-{4-[6-amino-5-cyano-3-(methoxymethyl)-2H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenoxy}-N,N-diethylacetamide

IUPAC name

2-{4-[6-amino-5-cyano-3-(methoxymethyl)-2H4H-pyrano[23-c]pyrazol-4-yl]-2-methoxyphenoxy}-NN-diethylacetamide

SMILES

CCN(CC)C(COc(ccc(C1C(C#N)=C(N)Oc2n[nH]c(COC)c12)c1)c1OC)=O

InChI

InChI=1S/C22H27N5O5/c1-5-27(6-2)18(28)12-31-16-8-7-13(9-17(16)30-4)19-14(10-23)21(24)32-22-20(19)15(11-29-3)25-26-22/h7-9,19H,5-6,11-12,24H2,1-4H3,(H,25,26)/t19-/m0/s1

InChI Key

PAIQHAKPAIEBBT-IBGZPJMESA-N

MDL Number (MFCD)

MFCD01606439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.713

Distribution Coefficient, logD

0.713

Water Solubility, LogSw

-2.00

Polar Surface Area

110.285

Acid Dissociation Constant (pKa)

13.05

Base Dissociation Constant (pKb)

1.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

3132-1237 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3132-1237 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3132-1237?
Check Price and Availability of 3132-1237, 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 3132-1237 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3132-1237
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3132-1237
  • 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 3132-1237 available by request