V004-7733 Screening compound: methyl 4-({2-[4-(2-methoxy-5-methylbenzenesulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate

V004-7733 Screening compound: methyl 4-({2-[4-(2-methoxy-5-methylbenzenesulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
V004-7733 Screening compound: methyl 4-({2-[4-(2-methoxy-5-methylbenzenesulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-7733
methyl 4-({2-[4-(2-methoxy-5-methylbenzenesulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate

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

V004-7733

Molecular Formula

C30H36N2O7S (C30 H36 N2 O7 S)

Compound Name

methyl 4-({2-[4-(2-methoxy-5-methylbenzenesulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate

IUPAC name

methyl 4-({2-[4-(2-methoxy-5-methylbenzenesulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate

SMILES

Cc(cc1)cc(S(N2CCN(CC(c3cc(OC)ccc3)OCc(cc3)ccc3C(OC)=O)CC2)(=O)=O)c1OC

InChI

InChI=1S/C30H36N2O7S/c1-22-8-13-27(37-3)29(18-22)40(34,35)32-16-14-31(15-17-32)20-28(25-6-5-7-26(19-25)36-2)39-21-23-9-11-24(12-10-23)30(33)38-4/h5-13,18-19,28H,14-17,20-21H2,1-4H3/t28-/m0/s1

InChI Key

XDCBZQJAWGRBPF-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19961380

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

568.69

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.527

Distribution Coefficient, logD

4.526

Water Solubility, LogSw

-4.30

Polar Surface Area

78.718

Acid Dissociation Constant (pKa)

23.56

Base Dissociation Constant (pKb)

4.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.70

References: we are preparing a list of scientific research reports with V004-7733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-7733?
Check Price and Availability of V004-7733, 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 V004-7733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-7733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-7733
  • 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 V004-7733 available by request