3132-0832 Screening compound: 6-amino-3-methyl-4-[4-(propan-2-yloxy)phenyl]-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

3132-0832 Screening compound: 6-amino-3-methyl-4-[4-(propan-2-yloxy)phenyl]-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile
3132-0832 Screening compound: 6-amino-3-methyl-4-[4-(propan-2-yloxy)phenyl]-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 3132-0832
6-amino-3-methyl-4-[4-(propan-2-yloxy)phenyl]-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

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

3132-0832

Molecular Formula

C17H18N4O2 (C17 H18 N4 O2)

Compound Name

6-amino-3-methyl-4-[4-(propan-2-yloxy)phenyl]-2H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

IUPAC name

6-amino-3-methyl-4-[4-(propan-2-yloxy)phenyl]-2H4H-pyrano[23-c]pyrazole-5-carbonitrile

SMILES

CC(C)Oc1ccc(C2C(C#N)=C(N)Oc3n[nH]c(C)c23)cc1

InChI

InChI=1S/C17H18N4O2/c1-9(2)22-12-6-4-11(5-7-12)15-13(8-18)16(19)23-17-14(15)10(3)20-21-17/h4-7,9,15H,19H2,1-3H3,(H,20,21)/t15-/m1/s1

InChI Key

OJJRJALCOPUXJS-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD01605173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.601

Distribution Coefficient, logD

2.601

Water Solubility, LogSw

-3.05

Polar Surface Area

77.354

Acid Dissociation Constant (pKa)

13.05

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with 3132-0832 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3132-0832?
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What is the minimum amount of 3132-0832 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3132-0832
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3132-0832
  • 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 3132-0832 available by request