1890-1204 Screening compound: N-benzyl-N-methyl-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide

1890-1204 Screening compound: N-benzyl-N-methyl-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
1890-1204 Screening compound: N-benzyl-N-methyl-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1890-1204
N-benzyl-N-methyl-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-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

1890-1204

Molecular Formula

C27H22N4O (C27 H22 N4 O)

Compound Name

N-benzyl-N-methyl-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide

IUPAC name

N-benzyl-N-methyl-57-diphenylpyrazolo[15-a]pyrimidine-2-carboxamide

SMILES

CN(Cc1ccccc1)C(c1nn2c(-c3ccccc3)cc(-c3ccccc3)nc2c1)=O

InChI

InChI=1S/C27H22N4O/c1-30(19-20-11-5-2-6-12-20)27(32)24-18-26-28-23(21-13-7-3-8-14-21)17-25(31(26)29-24)22-15-9-4-10-16-22/h2-18H,19H2,1H3

InChI Key

ZJSWTFDCYDLVHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01050967

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.871

Distribution Coefficient, logD

5.870

Water Solubility, LogSw

-5.51

Polar Surface Area

34.276

Acid Dissociation Constant (pKa)

27.46

Base Dissociation Constant (pKb)

4.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.40

1890-1204 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1890-1204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1890-1204?
Check Price and Availability of 1890-1204, 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 1890-1204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1890-1204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1890-1204
  • 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 1890-1204 available by request