V001-5407 Screening compound: 1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-1-heptanone

V001-5407 Screening compound: 1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-1-heptanone
V001-5407 Screening compound: 1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-1-heptanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-5407
1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-1-heptanone

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

V001-5407

Molecular Formula

C25H36N4OS (C25 H36 N4 OS)

Compound Name

1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-1-heptanone

IUPAC name

1-(4-{5-cyclopropyl-8-thia-46-diazatricyclo[7.5.0.0^{27}]tetradeca-1(9)2(7)35-tetraen-3-yl}piperazin-1-yl)heptan-1-one

SMILES

CCCCCCC(N(CC1)CCN1c1c(c(CCCCC2)c2s2)c2nc(C2CC2)n1)=O

InChI

InChI=1S/C25H36N4OS/c1-2-3-4-8-11-21(30)28-14-16-29(17-15-28)24-22-19-9-6-5-7-10-20(19)31-25(22)27-23(26-24)18-12-13-18/h18H,2-17H2,1H3

InChI Key

VMLZKDHKGJOAKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19852373

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

440.65

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.884

Distribution Coefficient, logD

5.159

Water Solubility, LogSw

-5.88

Polar Surface Area

40.003

Acid Dissociation Constant (pKa)

22.62

Base Dissociation Constant (pKb)

9.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

72.00

V001-5407 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V001-5407 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-5407?
Check Price and Availability of V001-5407, 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 V001-5407 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-5407
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-5407
  • 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 V001-5407 available by request