3209-1401 Screening compound: 3-bromo-5-(5-bromofuran-2-yl)-N-[3-(1-hydroxyethyl)phenyl]-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound 3209-1401
3-bromo-5-(5-bromofuran-2-yl)-N-[3-(1-hydroxyethyl)phenyl]-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
3209-1401
Molecular Formula
C20H17Br2F3N4O3 (C20 H17 Br2 F3 N4 O3)
Compound Name
3-bromo-5-(5-bromofuran-2-yl)-N-[3-(1-hydroxyethyl)phenyl]-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine-2-carboxamide
IUPAC name
(5R7S)-3-bromo-5-(5-bromofuran-2-yl)-N-[3-(1-hydroxyethyl)phenyl]-7-(trifluoromethyl)-4H5H6H7H-pyrazolo[15-a]pyrimidine-2-carboxamide
SMILES
CC(c1cccc(NC(c2nn([C@H](C[C@@H](c(o3)ccc3Br)N3)C(F)(F)F)c3c2Br)=O)c1)O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
578.18
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.585
Distribution Coefficient, logD
4.585
Water Solubility, LogSw
-4.32
Polar Surface Area
74.088
Acid Dissociation Constant (pKa)
11.89
Base Dissociation Constant (pKb)
-1.27
Number of Chiral Centers
3.00
Percent sp3 carbon bonding
30.00
References: we are preparing a list of scientific research reports with 3209-1401 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)