D491-1575 Screening compound: 5-bromo-N-[2-(dimethylamino)-2-phenylethyl]-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound D491-1575
5-bromo-N-[2-(dimethylamino)-2-phenylethyl]-3-methyl-1-benzofuran-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
D491-1575
Molecular Formula
C20H21BrN2O2 (C20 H21 BrN2 O2)
Compound Name
5-bromo-N-[2-(dimethylamino)-2-phenylethyl]-3-methyl-1-benzofuran-2-carboxamide
IUPAC name
5-bromo-N-[2-(dimethylamino)-2-phenylethyl]-3-methyl-1-benzofuran-2-carboxamide
SMILES
Cc1c(C(NCC(c2ccccc2)N(C)C)=O)oc(cc2)c1cc2Br
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
401.3
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.381
Distribution Coefficient, logD
4.097
Water Solubility, LogSw
-4.32
Polar Surface Area
35.519
Acid Dissociation Constant (pKa)
11.47
Base Dissociation Constant (pKb)
7.36
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
25.00
D491-1575 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Antiviral Library (67538 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Antiviral
- Infections
- Immune system
- Nervous system
- Epigenetic
References: we are preparing a list of scientific research reports with D491-1575 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)