V027-0984 Screening compound: 2-[1-(4-tert-butylphenyl)-N-pentylformamido]-N-(1,3-diphenyl-1H-pyrazol-5-yl)acetamide
Chemical Structure Depiction of ChemDiv screening compound V027-0984
2-[1-(4-tert-butylphenyl)-N-pentylformamido]-N-(1,3-diphenyl-1H-pyrazol-5-yl)acetamide
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
V027-0984
Molecular Formula
C33H38N4O2 (C33 H38 N4 O2)
Compound Name
2-[1-(4-tert-butylphenyl)-N-pentylformamido]-N-(1,3-diphenyl-1H-pyrazol-5-yl)acetamide
IUPAC name
2-[1-(4-tert-butylphenyl)-N-pentylformamido]-N-(13-diphenyl-1H-pyrazol-5-yl)acetamide
SMILES
CCCCCN(CC(Nc1cc(-c2ccccc2)nn1-c1ccccc1)=O)C(c1ccc(C(C)(C)C)cc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
522.69
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
13.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
8.123
Distribution Coefficient, logD
8.123
Water Solubility, LogSw
-5.61
Polar Surface Area
53.741
Acid Dissociation Constant (pKa)
13.56
Base Dissociation Constant (pKb)
-2.20
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
30.30
V027-0984 in Drug Discovery
Included in Screening Libraries
3CLpro Library (4801 compounds)
CORONAVIRUS Library (20774 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- 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 V027-0984 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)