E955-1915 Screening compound: tert-butyl 4-[1-(2,6-dimethylphenyl)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of ChemDiv screening compound E955-1915
tert-butyl 4-[1-(2,6-dimethylphenyl)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate
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
E955-1915
Molecular Formula
C32H40FN5O3 (C32 H40 FN5 O3)
Compound Name
tert-butyl 4-[1-(2,6-dimethylphenyl)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate
IUPAC name
tert-butyl 4-[1-(26-dimethylphenyl)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1H-pyrazol-5-yl]piperidine-1-carboxylate
SMILES
CC(C)(C)OC(N(CC1)CCC1c(n(-c1c(C)cccc1C)nc1)c1C(N(CC1)CCN1c(cc1)ccc1F)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
561.7
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
6.667
Distribution Coefficient, logD
6.667
Water Solubility, LogSw
-5.67
Polar Surface Area
54.450
Acid Dissociation Constant (pKa)
22.01
Base Dissociation Constant (pKb)
1.64
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
46.90
References: we are preparing a list of scientific research reports with E955-1915 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)