V018-5275 Screening compound: 2-(4-{2-methoxy-5-[(3-methylpiperidin-1-yl)sulfonyl]phenyl}piperazin-1-yl)-2-oxoethyl acetate

V018-5275 Screening compound: 2-(4-{2-methoxy-5-[(3-methylpiperidin-1-yl)sulfonyl]phenyl}piperazin-1-yl)-2-oxoethyl acetate
V018-5275 Screening compound: 2-(4-{2-methoxy-5-[(3-methylpiperidin-1-yl)sulfonyl]phenyl}piperazin-1-yl)-2-oxoethyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-5275
2-(4-{2-methoxy-5-[(3-methylpiperidin-1-yl)sulfonyl]phenyl}piperazin-1-yl)-2-oxoethyl 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

V018-5275

Molecular Formula

C21H31N3O6S (C21 H31 N3 O6 S)

Compound Name

2-(4-{2-methoxy-5-[(3-methylpiperidin-1-yl)sulfonyl]phenyl}piperazin-1-yl)-2-oxoethyl acetate

IUPAC name

2-(4-{2-methoxy-5-[(3-methylpiperidin-1-yl)sulfonyl]phenyl}piperazin-1-yl)-2-oxoethyl acetate

SMILES

CC(CCC1)CN1S(c(cc1)cc(N(CC2)CCN2C(COC(C)=O)=O)c1OC)(=O)=O

InChI

InChI=1S/C21H31N3O6S/c1-16-5-4-8-24(14-16)31(27,28)18-6-7-20(29-3)19(13-18)22-9-11-23(12-10-22)21(26)15-30-17(2)25/h6-7,13,16H,4-5,8-12,14-15H2,1-3H3/t16-/m0/s1

InChI Key

ZQLHSKRARCVNIM-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19950379

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

453.56

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.808

Distribution Coefficient, logD

1.808

Water Solubility, LogSw

-2.61

Polar Surface Area

80.096

Acid Dissociation Constant (pKa)

23.66

Base Dissociation Constant (pKb)

2.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.90

References: we are preparing a list of scientific research reports with V018-5275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-5275?
Check Price and Availability of V018-5275, 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 V018-5275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-5275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-5275
  • 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 V018-5275 available by request