3209-1191 Screening compound: 1-[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-(4-fluorophenyl)piperazine

3209-1191 Screening compound: 1-[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-(4-fluorophenyl)piperazine
3209-1191 Screening compound: 1-[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-(4-fluorophenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3209-1191
1-[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-(4-fluorophenyl)piperazine

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

3209-1191

Molecular Formula

C24H21Cl2F4N5O (C24 H21 Cl2 F4 N5 O)

Compound Name

1-[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-(4-fluorophenyl)piperazine

IUPAC name

1-[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4H5H6H7H-pyrazolo[15-a]pyrimidine-2-carbonyl]-4-(4-fluorophenyl)piperazine

SMILES

O=C(c1nn(C(CC(c(cc2)ccc2Cl)N2)C(F)(F)F)c2c1Cl)N(CC1)CCN1c(cc1)ccc1F

InChI

InChI=1S/C24H21Cl2F4N5O/c25-15-3-1-14(2-4-15)18-13-19(24(28,29)30)35-22(31-18)20(26)21(32-35)23(36)34-11-9-33(10-12-34)17-7-5-16(27)6-8-17/h1-8,18-19,31H,9-13H2

InChI Key

PAIXWZWNBPXTHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01923124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

542.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.609

Distribution Coefficient, logD

5.609

Water Solubility, LogSw

-6.18

Polar Surface Area

45.969

Acid Dissociation Constant (pKa)

15.75

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 3209-1191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3209-1191?
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What is the minimum amount of 3209-1191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3209-1191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3209-1191
  • 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 3209-1191 available by request