V005-7526 Screening compound: (2,4-dimethoxyphenyl)[4-(2-isopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]methanone

V005-7526 Screening compound: (2,4-dimethoxyphenyl)[4-(2-isopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]methanone
V005-7526 Screening compound: (2,4-dimethoxyphenyl)[4-(2-isopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-7526
(2,4-dimethoxyphenyl)[4-(2-isopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]methanone

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

V005-7526

Molecular Formula

C27H34N4O3S (C27 H34 N4 O3 S)

Compound Name

(2,4-dimethoxyphenyl)[4-(2-isopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]methanone

IUPAC name

3-[4-(24-dimethoxybenzoyl)piperazin-1-yl]-5-(propan-2-yl)-8-thia-46-diazatricyclo[7.5.0.0^{27}]tetradeca-1(9)2(7)35-tetraene

SMILES

CC(C)c1nc(N(CC2)CCN2C(c(ccc(OC)c2)c2OC)=O)c(c(CCCCC2)c2s2)c2n1

InChI

InChI=1S/C27H34N4O3S/c1-17(2)24-28-25(23-20-8-6-5-7-9-22(20)35-26(23)29-24)30-12-14-31(15-13-30)27(32)19-11-10-18(33-3)16-21(19)34-4/h10-11,16-17H,5-9,12-15H2,1-4H3

InChI Key

HQZHIPOIMOYBJL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19852474

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

494.66

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.000

Distribution Coefficient, logD

5.504

Water Solubility, LogSw

-5.60

Polar Surface Area

55.182

Acid Dissociation Constant (pKa)

22.46

Base Dissociation Constant (pKb)

7.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

51.90

References: we are preparing a list of scientific research reports with V005-7526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-7526?
Check Price and Availability of V005-7526, 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 V005-7526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-7526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-7526
  • 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 V005-7526 available by request