L056-2131 Screening compound: 2-ethyl-N-{[1-(4-methoxybenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}butanamide
Chemical Structure Depiction of ChemDiv screening compound L056-2131
2-ethyl-N-{[1-(4-methoxybenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}butanamide
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
L056-2131
Molecular Formula
C23H28N2O3 (C23 H28 N2 O3)
Compound Name
2-ethyl-N-{[1-(4-methoxybenzoyl)-2,3-dihydro-1H-indol-6-yl]methyl}butanamide
IUPAC name
2-ethyl-N-{[1-(4-methoxybenzoyl)-23-dihydro-1H-indol-6-yl]methyl}butanamide
SMILES
CCC(CC)C(NCc1cc(N(CC2)C(c(cc3)ccc3OC)=O)c2cc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
380.49
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.683
Distribution Coefficient, logD
3.683
Water Solubility, LogSw
-3.88
Polar Surface Area
48.146
Acid Dissociation Constant (pKa)
12.39
Base Dissociation Constant (pKb)
-0.05
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
39.10
L056-2131 in Drug Discovery
Included in Screening Libraries
Epigenetics Focused Set (26518 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Epigenetic
References: we are preparing a list of scientific research reports with L056-2131 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)