V009-3399 Screening compound: 3-chloro-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-(pyrrolidin-1-yl)phenyl)-2,2-dimethylpropanamide

V009-3399 Screening compound: 3-chloro-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-(pyrrolidin-1-yl)phenyl)-2,2-dimethylpropanamide
V009-3399 Screening compound: 3-chloro-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-(pyrrolidin-1-yl)phenyl)-2,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-3399
3-chloro-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-(pyrrolidin-1-yl)phenyl)-2,2-dimethylpropanamide

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

V009-3399

Molecular Formula

C25H34ClN3O5S (C25 H34 ClN3 O5 S)

Compound Name

3-chloro-N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]sulfamoyl}-4-(pyrrolidin-1-yl)phenyl)-2,2-dimethylpropanamide

IUPAC name

3-chloro-N-(3-{[2-(34-dimethoxyphenyl)ethyl]sulfamoyl}-4-(pyrrolidin-1-yl)phenyl)-22-dimethylpropanamide

SMILES

CC(C)(CCl)C(Nc(cc1)cc(S(NCCc(cc2)cc(OC)c2OC)(=O)=O)c1N1CCCC1)=O

InChI

InChI=1S/C25H34ClN3O5S/c1-25(2,17-26)24(30)28-19-8-9-20(29-13-5-6-14-29)23(16-19)35(31,32)27-12-11-18-7-10-21(33-3)22(15-18)34-4/h7-10,15-16,27H,5-6,11-14,17H2,1-4H3,(H,28,30)

InChI Key

QJRIIRVYNVBBBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19972433

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

524.08

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.493

Distribution Coefficient, logD

4.492

Water Solubility, LogSw

-4.26

Polar Surface Area

83.979

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

0.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

V009-3399 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Lipid Metabolism Library (9174 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with V009-3399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-3399?
Check Price and Availability of V009-3399, 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 V009-3399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-3399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-3399
  • 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 V009-3399 available by request