Y043-1283 Screening compound: 1-{2-[3-(4-fluorophenyl)-6-oxo-1(6H)-pyridazinyl]acetyl}-3-piperidinecarboxylic acid
Chemical Structure Depiction of ChemDiv screening compound Y043-1283
1-{2-[3-(4-fluorophenyl)-6-oxo-1(6H)-pyridazinyl]acetyl}-3-piperidinecarboxylic acid
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
Y043-1283
Molecular Formula
C18H18FN3O4 (C18 H18 FN3 O4)
Compound Name
1-{2-[3-(4-fluorophenyl)-6-oxo-1(6H)-pyridazinyl]acetyl}-3-piperidinecarboxylic acid
IUPAC name
1-{2-[3-(4-fluorophenyl)-6-oxo-16-dihydropyridazin-1-yl]acetyl}piperidine-3-carboxylic acid
SMILES
OC(C(CCC1)CN1C(CN(C(C=C1)=O)N=C1c(cc1)ccc1F)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
359.36
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
0.660
Distribution Coefficient, logD
-1.768
Water Solubility, LogSw
-1.33
Polar Surface Area
73.282
Acid Dissociation Constant (pKa)
4.97
Base Dissociation Constant (pKb)
-0.81
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
33.33
Y043-1283 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 Y043-1283 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)