V006-8017 Screening compound: [(2H-1,3-benzodioxol-5-yl)methyl][(2,4-dimethoxyphenyl)methyl]({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methyl)amine

V006-8017 Screening compound: [(2H-1,3-benzodioxol-5-yl)methyl][(2,4-dimethoxyphenyl)methyl]({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methyl)amine
V006-8017 Screening compound: [(2H-1,3-benzodioxol-5-yl)methyl][(2,4-dimethoxyphenyl)methyl]({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methyl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-8017
[(2H-1,3-benzodioxol-5-yl)methyl][(2,4-dimethoxyphenyl)methyl]({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methyl)amine

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

V006-8017

Molecular Formula

C32H33N5O7S (C32 H33 N5 O7 S)

Compound Name

[(2H-1,3-benzodioxol-5-yl)methyl][(2,4-dimethoxyphenyl)methyl]({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl}methyl)amine

IUPAC name

[(2H-13-benzodioxol-5-yl)methyl][(24-dimethoxyphenyl)methyl]({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]-13-thiazol-2-yl}methyl)amine

SMILES

COc1cc(OC)c(CN(Cc2nc(C(N(CC3)CCN3c(cc3)ccc3[N+]([O-])=O)=O)cs2)Cc(cc2)cc3c2OCO3)cc1

InChI

InChI=1S/C32H33N5O7S/c1-41-26-9-4-23(29(16-26)42-2)18-34(17-22-3-10-28-30(15-22)44-21-43-28)19-31-33-27(20-45-31)32(38)36-13-11-35(12-14-36)24-5-7-25(8-6-24)37(39)40/h3-10,15-16,20H,11-14,17-19,21H2,1-2H3

InChI Key

PZLRENSAZYENPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19759900

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

631.71

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

5.226

Distribution Coefficient, logD

5.225

Water Solubility, LogSw

-5.12

Polar Surface Area

99.759

Acid Dissociation Constant (pKa)

26.34

Base Dissociation Constant (pKb)

4.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

References: we are preparing a list of scientific research reports with V006-8017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-8017?
Check Price and Availability of V006-8017, 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 V006-8017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-8017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-8017
  • 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 V006-8017 available by request