3209-1365 Screening compound: N-benzyl-5-(4-chlorophenyl)-N-methyl-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound 3209-1365
N-benzyl-5-(4-chlorophenyl)-N-methyl-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[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
3209-1365
Molecular Formula
C22H20ClF3N4O (C22 H20 ClF3 N4 O)
Compound Name
N-benzyl-5-(4-chlorophenyl)-N-methyl-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide
IUPAC name
N-benzyl-5-(4-chlorophenyl)-N-methyl-7-(trifluoromethyl)-4H5H6H7H-pyrazolo[15-a]pyrimidine-2-carboxamide
SMILES
CN(Cc1ccccc1)C(c1nn(C(CC(c(cc2)ccc2Cl)N2)C(F)(F)F)c2c1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
448.88
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.152
Distribution Coefficient, logD
5.152
Water Solubility, LogSw
-5.84
Polar Surface Area
43.917
Acid Dissociation Constant (pKa)
17.64
Base Dissociation Constant (pKb)
-4.19
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
27.30
3209-1365 in Drug Discovery
Included in Screening Libraries
MCE-18 Trends in Medicinal Chemistry (51288 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with 3209-1365 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.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)