F290-0680 Screening compound: 5-[(dimethylsulfamoyl)amino]-2-(4-{[(3-methoxypropyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid

F290-0680 Screening compound: 5-[(dimethylsulfamoyl)amino]-2-(4-{[(3-methoxypropyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid
F290-0680 Screening compound: 5-[(dimethylsulfamoyl)amino]-2-(4-{[(3-methoxypropyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound F290-0680
5-[(dimethylsulfamoyl)amino]-2-(4-{[(3-methoxypropyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid

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

F290-0680

Molecular Formula

C19H31N5O6S (C19 H31 N5 O6 S)

Compound Name

5-[(dimethylsulfamoyl)amino]-2-(4-{[(3-methoxypropyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid

IUPAC name

5-[(dimethylsulfamoyl)amino]-2-(4-{[(3-methoxypropyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid

SMILES

CN(C)S(Nc(cc1)cc(C(O)=O)c1N1CCN(CC(NCCCOC)=O)CC1)(=O)=O

InChI

InChI=1S/C19H31N5O6S/c1-22(2)31(28,29)21-15-5-6-17(16(13-15)19(26)27)24-10-8-23(9-11-24)14-18(25)20-7-4-12-30-3/h5-6,13,21H,4,7-12,14H2,1-3H3,(H,20,25)(H,26,27)

InChI Key

NNVZKCOMTLZMAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14947424

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.773

Distribution Coefficient, logD

-1.343

Water Solubility, LogSw

-2.40

Polar Surface Area

113.607

Acid Dissociation Constant (pKa)

5.29

Base Dissociation Constant (pKb)

6.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

F290-0680 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with F290-0680 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F290-0680?
Check Price and Availability of F290-0680, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F290-0680 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F290-0680
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F290-0680
  • 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 F290-0680 available by request