8008-4613 Screening compound: N-[3-({[2-(diethylamino)ethyl]amino}methyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
Chemical Structure Depiction of ChemDiv screening compound 8008-4613
N-[3-({[2-(diethylamino)ethyl]amino}methyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
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
8008-4613
Molecular Formula
C22H31N3OS (C22 H31 N3 OS)
Compound Name
N-[3-({[2-(diethylamino)ethyl]amino}methyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
IUPAC name
N-[3-({[2-(diethylamino)ethyl]amino}methyl)-4567-tetrahydro-1-benzothiophen-2-yl]benzamide
SMILES
CCN(CC)CCNCc1c(NC(c2ccccc2)=O)sc2c1CCCC2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
385.57
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.126
Distribution Coefficient, logD
1.112
Water Solubility, LogSw
-4.00
Polar Surface Area
38.335
Acid Dissociation Constant (pKa)
7.73
Base Dissociation Constant (pKb)
10.59
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
References: we are preparing a list of scientific research reports with 8008-4613 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)