G207-1038 Screening compound: N~4~-(4-ethoxybenzyl)-1-[5-(4-methoxyphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-4-piperidinecarboxamide

G207-1038 Screening compound: N~4~-(4-ethoxybenzyl)-1-[5-(4-methoxyphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-4-piperidinecarboxamide
G207-1038 Screening compound: N~4~-(4-ethoxybenzyl)-1-[5-(4-methoxyphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G207-1038
N~4~-(4-ethoxybenzyl)-1-[5-(4-methoxyphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-4-piperidinecarboxamide

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

G207-1038

Molecular Formula

C26H31N3O5S (C26 H31 N3 O5 S)

Compound Name

N~4~-(4-ethoxybenzyl)-1-[5-(4-methoxyphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-4-piperidinecarboxamide

IUPAC name

N-[(4-ethoxyphenyl)methyl]-1-[5-(4-methoxyphenyl)-4-methyl-11-dioxo-1lambda62-thiazol-3-yl]piperidine-4-carboxamide

SMILES

CCOc1ccc(CNC(C(CC2)CCN2C(C(C)=C2c(cc3)ccc3OC)=NS2(=O)=O)=O)cc1

InChI

InChI=1S/C26H31N3O5S/c1-4-34-23-9-5-19(6-10-23)17-27-26(30)21-13-15-29(16-14-21)25-18(2)24(35(31,32)28-25)20-7-11-22(33-3)12-8-20/h5-12,21H,4,13-17H2,1-3H3,(H,27,30)

InChI Key

NTFHABUDDCPBIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14986120

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.297

Distribution Coefficient, logD

3.297

Water Solubility, LogSw

-3.29

Polar Surface Area

82.211

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

-1.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with G207-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G207-1038?
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What is the minimum amount of G207-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G207-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G207-1038
  • 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 G207-1038 available by request