P757-0458 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(propan-2-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide

P757-0458 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(propan-2-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
P757-0458 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(propan-2-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P757-0458
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(propan-2-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide

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

P757-0458

Molecular Formula

C18H18N4O3 (C18 H18 N4 O3)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(propan-2-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-7-(propan-2-yl)pyrazolo[15-a]pyrimidine-5-carboxamide

SMILES

CC(C)c1cc(C(Nc(cc2)cc3c2OCCO3)=O)nc2ccnn12

InChI

InChI=1S/C18H18N4O3/c1-11(2)14-10-13(21-17-5-6-19-22(14)17)18(23)20-12-3-4-15-16(9-12)25-8-7-24-15/h3-6,9-11H,7-8H2,1-2H3,(H,20,23)

InChI Key

LMXHWAUCEXDITP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614317

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.125

Distribution Coefficient, logD

2.120

Water Solubility, LogSw

-3.06

Polar Surface Area

57.718

Acid Dissociation Constant (pKa)

9.36

Base Dissociation Constant (pKb)

0.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with P757-0458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P757-0458?
Check Price and Availability of P757-0458, 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 P757-0458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P757-0458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P757-0458
  • 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 P757-0458 available by request