D411-0190 Screening compound: N-{3-[(2-methoxyphenyl)(morpholin-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound D411-0190
N-{3-[(2-methoxyphenyl)(morpholin-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-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
D411-0190
Molecular Formula
C25H28N2O4S (C25 H28 N2 O4 S)
Compound Name
N-{3-[(2-methoxyphenyl)(morpholin-4-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
IUPAC name
N-{3-[(2-methoxyphenyl)(morpholin-4-yl)methyl]-4567-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide
SMILES
COc1c(C(c2c(NC(c3ccco3)=O)sc3c2CCCC3)N2CCOCC2)cccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
452.57
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.736
Distribution Coefficient, logD
4.195
Water Solubility, LogSw
-4.39
Polar Surface Area
49.915
Acid Dissociation Constant (pKa)
8.86
Base Dissociation Constant (pKb)
7.79
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
40.00
D411-0190 in Drug Discovery
Included in Screening Libraries
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cardiovascular
- Ion Channels
References: we are preparing a list of scientific research reports with D411-0190 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)