K784-8445 Screening compound: N-{3-[BIS(2-METHYLPROPYL)AMINO]PROPYL}-6-[(2-CHLORO-6-FLUOROPHENYL)METHYL]-5,7-DIMETHYLPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE
Chemical Structure Depiction of ChemDiv screening compound K784-8445
N-{3-[BIS(2-METHYLPROPYL)AMINO]PROPYL}-6-[(2-CHLORO-6-FLUOROPHENYL)METHYL]-5,7-DIMETHYLPYRAZOLO[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
K784-8445
Molecular Formula
C27H37ClFN5O (C27 H37 ClFN5 O)
Compound Name
N-{3-[BIS(2-METHYLPROPYL)AMINO]PROPYL}-6-[(2-CHLORO-6-FLUOROPHENYL)METHYL]-5,7-DIMETHYLPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE
IUPAC name
N-{3-[bis(2-methylpropyl)amino]propyl}-6-[(2-chloro-6-fluorophenyl)methyl]-57-dimethylpyrazolo[15-a]pyrimidine-3-carboxamide
SMILES
CC(C)CN(CCCNC(c1c2nc(C)c(Cc(c(F)ccc3)c3Cl)c(C)n2nc1)=O)CC(C)C
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
502.07
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
12.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.693
Distribution Coefficient, logD
2.897
Water Solubility, LogSw
-5.84
Polar Surface Area
48.979
Acid Dissociation Constant (pKa)
14.62
Base Dissociation Constant (pKb)
10.19
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
51.90
K784-8445 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Eccentric PPI Library (11937 compounds)
Human Proteases Annotated Library (2868 compounds)
Protein-Protein Interaction Library (218420 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Cyclic compounds
- PPI modulators
- PPI modulators
References: we are preparing a list of scientific research reports with K784-8445 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of K784-8445, 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.
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)