G207-0733 Screening compound: 1-[5-(4-isopropylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-[(5-methyl-2-furyl)methyl]-4-piperidinecarboxamide

G207-0733 Screening compound: 1-[5-(4-isopropylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-[(5-methyl-2-furyl)methyl]-4-piperidinecarboxamide
G207-0733 Screening compound: 1-[5-(4-isopropylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-[(5-methyl-2-furyl)methyl]-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G207-0733
1-[5-(4-isopropylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-[(5-methyl-2-furyl)methyl]-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

G207-0733

Molecular Formula

C25H31N3O4S (C25 H31 N3 O4 S)

Compound Name

1-[5-(4-isopropylphenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~-isothiazol-3-yl]-N~4~-[(5-methyl-2-furyl)methyl]-4-piperidinecarboxamide

IUPAC name

1-{4-methyl-11-dioxo-5-[4-(propan-2-yl)phenyl]-1lambda62-thiazol-3-yl}-N-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide

SMILES

CC(C)c(cc1)ccc1C1=C(C)C(N(CC2)CCC2C(NCc2ccc(C)o2)=O)=NS1(=O)=O

InChI

InChI=1S/C25H31N3O4S/c1-16(2)19-6-8-20(9-7-19)23-18(4)24(27-33(23,30)31)28-13-11-21(12-14-28)25(29)26-15-22-10-5-17(3)32-22/h5-10,16,21H,11-15H2,1-4H3,(H,26,29)

InChI Key

HAQMYRDTNVEPFA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14986013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.341

Distribution Coefficient, logD

4.341

Water Solubility, LogSw

-4.05

Polar Surface Area

74.806

Acid Dissociation Constant (pKa)

12.38

Base Dissociation Constant (pKb)

-0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

G207-0733 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G207-0733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G207-0733?
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What is the minimum amount of G207-0733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G207-0733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G207-0733
  • 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 G207-0733 available by request