V029-5360 Screening compound: 1-[(4-tert-butylphenyl)methyl]-5-(3-fluorobenzamido)-N-(2-methoxyethyl)-1H-indole-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound V029-5360
1-[(4-tert-butylphenyl)methyl]-5-(3-fluorobenzamido)-N-(2-methoxyethyl)-1H-indole-2-carboxamide
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
V029-5360
Molecular Formula
C30H32FN3O3 (C30 H32 FN3 O3)
Compound Name
1-[(4-tert-butylphenyl)methyl]-5-(3-fluorobenzamido)-N-(2-methoxyethyl)-1H-indole-2-carboxamide
IUPAC name
1-[(4-tert-butylphenyl)methyl]-5-(3-fluorobenzamido)-N-(2-methoxyethyl)-1H-indole-2-carboxamide
SMILES
CC(C)(C)c1ccc(Cn(c(C(NCCOC)=O)c2)c(cc3)c2cc3NC(c2cccc(F)c2)=O)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
501.6
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
6.323
Distribution Coefficient, logD
6.323
Water Solubility, LogSw
-5.77
Polar Surface Area
56.652
Acid Dissociation Constant (pKa)
10.92
Base Dissociation Constant (pKb)
-1.25
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
26.70
V029-5360 in Drug Discovery
Included in Screening Libraries
CORONAVIRUS Library (20774 compounds)
Indole Derivatives (10091 compounds)
Lipid Metabolism Library (9174 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Cardiovascular
- Metabolic
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Cyclic compounds
- Epigenetic
References: we are preparing a list of scientific research reports with V029-5360 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)