V015-7876 Screening compound: N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-4-fluoro-N-(2-methoxyethyl)benzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound V015-7876
N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-4-fluoro-N-(2-methoxyethyl)benzene-1-sulfonamide
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
V015-7876
Molecular Formula
C26H33F2N5O3S (C26 H33 F2 N5 O3 S)
Compound Name
N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-4-fluoro-N-(2-methoxyethyl)benzene-1-sulfonamide
IUPAC name
N-{[5-(4-ethylpiperazin-1-yl)-1-(3-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]methyl}-4-fluoro-N-(2-methoxyethyl)benzene-1-sulfonamide
SMILES
CCN(CC1)CCN1c1c(CN(CCOC)S(c(cc2)ccc2F)(=O)=O)c(C)nn1-c1cc(F)ccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
533.64
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.886
Distribution Coefficient, logD
1.818
Water Solubility, LogSw
-3.98
Polar Surface Area
60.148
Acid Dissociation Constant (pKa)
23.21
Base Dissociation Constant (pKb)
9.46
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
42.30
V015-7876 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
MCL1 Targeted Library (12200 compounds)
Included in 1.7M Stock Database
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
References: we are preparing a list of scientific research reports with V015-7876 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)