D337-1907 Screening compound: N~3~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-methoxybenzyl)-5-(4-methoxyphenyl)-3-isoxazolecarboxamide

D337-1907 Screening compound: N~3~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-methoxybenzyl)-5-(4-methoxyphenyl)-3-isoxazolecarboxamide
D337-1907 Screening compound: N~3~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-methoxybenzyl)-5-(4-methoxyphenyl)-3-isoxazolecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D337-1907
N~3~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-methoxybenzyl)-5-(4-methoxyphenyl)-3-isoxazolecarboxamide

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

D337-1907

Molecular Formula

C23H24N2O6S (C23 H24 N2 O6 S)

Compound Name

N~3~-(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)-N~3~-(3-methoxybenzyl)-5-(4-methoxyphenyl)-3-isoxazolecarboxamide

IUPAC name

N-(11-dioxo-1lambda6-thiolan-3-yl)-5-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-12-oxazole-3-carboxamide

SMILES

COc(cc1)ccc1-c1cc(C(N(Cc2cc(OC)ccc2)C(CC2)CS2(=O)=O)=O)no1

InChI

InChI=1S/C23H24N2O6S/c1-29-19-8-6-17(7-9-19)22-13-21(24-31-22)23(26)25(18-10-11-32(27,28)15-18)14-16-4-3-5-20(12-16)30-2/h3-9,12-13,18H,10-11,14-15H2,1-2H3/t18-/m1/s1

InChI Key

JWWHWSVKXQRTQF-GOSISDBHSA-N

MDL Number (MFCD)

MFCD12916619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.784

Distribution Coefficient, logD

2.784

Water Solubility, LogSw

-3.38

Polar Surface Area

80.482

Acid Dissociation Constant (pKa)

20.33

Base Dissociation Constant (pKb)

-7.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with D337-1907 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D337-1907?
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What is the minimum amount of D337-1907 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D337-1907
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D337-1907
  • 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 D337-1907 available by request