C202-0239 Screening compound: pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

C202-0239 Screening compound: pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
C202-0239 Screening compound: pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-0239
pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

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

C202-0239

Molecular Formula

C19H22F2N4O3 (C19 H22 F2 N4 O3)

Compound Name

pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

IUPAC name

pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H7H-[124]triazolo[15-a]pyrimidine-6-carboxylate

SMILES

CCCCCOC(C1=C(C)Nc2ncnn2C1c(cc1)ccc1OC(F)F)=O

InChI

InChI=1S/C19H22F2N4O3/c1-3-4-5-10-27-17(26)15-12(2)24-19-22-11-23-25(19)16(15)13-6-8-14(9-7-13)28-18(20)21/h6-9,11,16,18H,3-5,10H2,1-2H3,(H,22,23,24)/t16-/m0/s1

InChI Key

QLBWOURSRARKOA-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14729926

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.050

Distribution Coefficient, logD

3.762

Water Solubility, LogSw

-3.80

Polar Surface Area

65.643

Acid Dissociation Constant (pKa)

7.43

Base Dissociation Constant (pKb)

-3.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.10

References: we are preparing a list of scientific research reports with C202-0239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-0239?
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What is the minimum amount of C202-0239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-0239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-0239
  • 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 C202-0239 available by request