D103-1027 Screening compound: N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-6-methyl-4-oxo-4H-chromene-2-carboxamide

D103-1027 Screening compound: N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-6-methyl-4-oxo-4H-chromene-2-carboxamide
D103-1027 Screening compound: N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-6-methyl-4-oxo-4H-chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D103-1027
N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-6-methyl-4-oxo-4H-chromene-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

D103-1027

Molecular Formula

C23H24N2O5S (C23 H24 N2 O5 S)

Compound Name

N-{3-[(2-methoxyethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-6-methyl-4-oxo-4H-chromene-2-carboxamide

IUPAC name

N-{3-[(2-methoxyethyl)carbamoyl]-4567-tetrahydro-1-benzothiophen-2-yl}-6-methyl-4-oxo-4H-chromene-2-carboxamide

SMILES

Cc(cc1)cc2c1OC(C(Nc1c(C(NCCOC)=O)c(CCCC3)c3s1)=O)=CC2=O

InChI

InChI=1S/C23H24N2O5S/c1-13-7-8-17-15(11-13)16(26)12-18(30-17)21(27)25-23-20(22(28)24-9-10-29-2)14-5-3-4-6-19(14)31-23/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,24,28)(H,25,27)

InChI Key

ZLOJTRDCWDNKCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07425979

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.638

Distribution Coefficient, logD

1.202

Water Solubility, LogSw

-4.21

Polar Surface Area

77.732

Acid Dissociation Constant (pKa)

4.97

Base Dissociation Constant (pKb)

-3.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with D103-1027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D103-1027?
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What is the minimum amount of D103-1027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D103-1027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D103-1027
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of D103-1027 available by request