V019-3178 Screening compound: N-benzyl-N-({[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)octanamide
Chemical Structure Depiction of ChemDiv screening compound V019-3178
N-benzyl-N-({[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)octanamide
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
V019-3178
Molecular Formula
C32H35FN4O2 (C32 H35 FN4 O2)
Compound Name
N-benzyl-N-({[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)octanamide
IUPAC name
N-benzyl-N-({[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-yl]carbamoyl}methyl)octanamide
SMILES
CCCCCCCC(N(CC(Nc1cc(-c2ccccc2)nn1-c(cc1)ccc1F)=O)Cc1ccccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
526.65
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
15.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
7.472
Distribution Coefficient, logD
7.472
Water Solubility, LogSw
-5.60
Polar Surface Area
53.235
Acid Dissociation Constant (pKa)
13.33
Base Dissociation Constant (pKb)
-2.72
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
28.10
V019-3178 in Drug Discovery
Included in Screening Libraries
MCL1 Targeted Library (12200 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Epigenetic
References: we are preparing a list of scientific research reports with V019-3178 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)