V005-9086 Screening compound: 2-[4-(2-methoxy-5-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenyl)piperazin-1-yl]-2-oxo-1-phenylethyl acetate

V005-9086 Screening compound: 2-[4-(2-methoxy-5-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenyl)piperazin-1-yl]-2-oxo-1-phenylethyl acetate
V005-9086 Screening compound: 2-[4-(2-methoxy-5-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenyl)piperazin-1-yl]-2-oxo-1-phenylethyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-9086
2-[4-(2-methoxy-5-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenyl)piperazin-1-yl]-2-oxo-1-phenylethyl acetate

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

V005-9086

Molecular Formula

C28H38N4O7S (C28 H38 N4 O7 S)

Compound Name

2-[4-(2-methoxy-5-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenyl)piperazin-1-yl]-2-oxo-1-phenylethyl acetate

IUPAC name

2-[4-(2-methoxy-5-{[3-(morpholin-4-yl)propyl]sulfamoyl}phenyl)piperazin-1-yl]-2-oxo-1-phenylethyl acetate

SMILES

CC(OC(C(N(CC1)CCN1c(cc(cc1)S(NCCCN2CCOCC2)(=O)=O)c1OC)=O)c1ccccc1)=O

InChI

InChI=1S/C28H38N4O7S/c1-22(33)39-27(23-7-4-3-5-8-23)28(34)32-15-13-31(14-16-32)25-21-24(9-10-26(25)37-2)40(35,36)29-11-6-12-30-17-19-38-20-18-30/h3-5,7-10,21,27,29H,6,11-20H2,1-2H3/t27-/m1/s1

InChI Key

JTPSBAUSXPAWQY-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19950626

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

574.7

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.264

Distribution Coefficient, logD

2.071

Water Solubility, LogSw

-3.01

Polar Surface Area

101.475

Acid Dissociation Constant (pKa)

11.47

Base Dissociation Constant (pKb)

7.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

V005-9086 in Drug Discovery

Included in Screening Libraries

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Nervous system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V005-9086 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-9086?
Check Price and Availability of V005-9086, 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 V005-9086 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-9086
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-9086
  • 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 V005-9086 available by request