D051-0205 Screening compound: 3,5-dichloro-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~1~-[(5-methyl-2-furyl)methyl]-4-propoxybenzamide

D051-0205 Screening compound: 3,5-dichloro-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~1~-[(5-methyl-2-furyl)methyl]-4-propoxybenzamide
D051-0205 Screening compound: 3,5-dichloro-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~1~-[(5-methyl-2-furyl)methyl]-4-propoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D051-0205
3,5-dichloro-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~1~-[(5-methyl-2-furyl)methyl]-4-propoxybenzamide

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

D051-0205

Molecular Formula

C20H23Cl2NO5S (C20 H23 Cl2 NO5 S)

Compound Name

3,5-dichloro-N~1~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~1~-[(5-methyl-2-furyl)methyl]-4-propoxybenzamide

IUPAC name

35-dichloro-N-(11-dioxo-1lambda6-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]-4-propoxybenzamide

SMILES

CCCOc(c(Cl)cc(C(N(Cc1ccc(C)o1)C(CC1)CS1(=O)=O)=O)c1)c1Cl

InChI

InChI=1S/C20H23Cl2NO5S/c1-3-7-27-19-17(21)9-14(10-18(19)22)20(24)23(11-16-5-4-13(2)28-16)15-6-8-29(25,26)12-15/h4-5,9-10,15H,3,6-8,11-12H2,1-2H3/t15-/m0/s1

InChI Key

FSHGZLPWFOFMSB-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD06651381

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.995

Distribution Coefficient, logD

3.995

Water Solubility, LogSw

-4.46

Polar Surface Area

58.714

Acid Dissociation Constant (pKa)

20.25

Base Dissociation Constant (pKb)

-6.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.00

References: we are preparing a list of scientific research reports with D051-0205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D051-0205?
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What is the minimum amount of D051-0205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D051-0205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D051-0205
  • 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 D051-0205 available by request