6309-2565 Screening compound: 1-(2-chloro-4-nitrophenyl)-4-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}piperazine
Chemical Structure Depiction of ChemDiv screening compound 6309-2565
1-(2-chloro-4-nitrophenyl)-4-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}piperazine
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
6309-2565
Molecular Formula
C15H18ClN5O4 (C15 H18 ClN5 O4)
Compound Name
1-(2-chloro-4-nitrophenyl)-4-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}piperazine
IUPAC name
1-(2-chloro-4-nitrophenyl)-4-{2-[(4-methyl-125-oxadiazol-3-yl)oxy]ethyl}piperazine
SMILES
Cc1nonc1OCCN(CC1)CCN1c(ccc([N+]([O-])=O)c1)c1Cl
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
HCl
Molecular Weight
367.79
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.159
Distribution Coefficient, logD
2.813
Water Solubility, LogSw
-3.46
Polar Surface Area
84.660
Acid Dissociation Constant (pKa)
27.49
Base Dissociation Constant (pKb)
7.48
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
46.70
6309-2565 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with 6309-2565 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)