SA24-1222 Screening compound: {1-[1-(1-ethyl-3-methyl-1H-pyrazole-4-carbonyl)azetidin-3-yl]-4,4-difluoropyrrolidin-2-yl}methanol
Chemical Structure Depiction of ChemDiv screening compound SA24-1222
{1-[1-(1-ethyl-3-methyl-1H-pyrazole-4-carbonyl)azetidin-3-yl]-4,4-difluoropyrrolidin-2-yl}methanol
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
SA24-1222
Molecular Formula
C15H22F2N4O2 (C15 H22 F2 N4 O2)
Compound Name
{1-[1-(1-ethyl-3-methyl-1H-pyrazole-4-carbonyl)azetidin-3-yl]-4,4-difluoropyrrolidin-2-yl}methanol
IUPAC name
[(2S)-1-[1-(1-ethyl-3-methyl-1H-pyrazole-4-carbonyl)azetidin-3-yl]-44-difluoropyrrolidin-2-yl]methanol
SMILES
CCn1nc(C)c(C(N(C2)CC2N(C2)[C@H](CO)CC2(F)F)=O)c1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
328.36
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
0.087
Distribution Coefficient, logD
0.086
Water Solubility, LogSw
-1.01
Polar Surface Area
52.094
Acid Dissociation Constant (pKa)
15.36
Base Dissociation Constant (pKb)
4.58
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
73.33
SA24-1222 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
CNS BBB Library (22607 compounds)
Included in 1.7M Stock Database
- Nervous system
References: we are preparing a list of scientific research reports with SA24-1222 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)