S399-1935 Screening compound: 5,7-dimethyl-6-[(4-methylphenyl)methyl]-N-{2-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide

S399-1935 Screening compound: 5,7-dimethyl-6-[(4-methylphenyl)methyl]-N-{2-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide
S399-1935 Screening compound: 5,7-dimethyl-6-[(4-methylphenyl)methyl]-N-{2-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S399-1935
5,7-dimethyl-6-[(4-methylphenyl)methyl]-N-{2-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrazolo[1,5-a]pyrimidine-3-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

S399-1935

Molecular Formula

C26H25N7O2 (C26 H25 N7 O2)

Compound Name

5,7-dimethyl-6-[(4-methylphenyl)methyl]-N-{2-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide

IUPAC name

57-dimethyl-6-[(4-methylphenyl)methyl]-N-{2-[5-(pyridin-4-yl)-124-oxadiazol-3-yl]ethyl}pyrazolo[15-a]pyrimidine-3-carboxamide

SMILES

Cc1ccc(Cc2c(C)n3ncc(C(NCCc4noc(-c5ccncc5)n4)=O)c3nc2C)cc1

InChI

InChI=1S/C26H25N7O2/c1-16-4-6-19(7-5-16)14-21-17(2)30-24-22(15-29-33(24)18(21)3)25(34)28-13-10-23-31-26(35-32-23)20-8-11-27-12-9-20/h4-9,11-12,15H,10,13-14H2,1-3H3,(H,28,34)

InChI Key

WXQYKUKFQGQTBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31993337

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.378

Distribution Coefficient, logD

3.378

Water Solubility, LogSw

-3.47

Polar Surface Area

86.842

Acid Dissociation Constant (pKa)

13.95

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.08

References: we are preparing a list of scientific research reports with S399-1935 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S399-1935
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S399-1935
  • 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 S399-1935 available by request