V029-6104 Screening compound: 1-[4-(2-butyl-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazino]-1-ethanone

V029-6104 Screening compound: 1-[4-(2-butyl-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazino]-1-ethanone
V029-6104 Screening compound: 1-[4-(2-butyl-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazino]-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-6104
1-[4-(2-butyl-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazino]-1-ethanone

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

V029-6104

Molecular Formula

C21H30N4OS (C21 H30 N4 OS)

Compound Name

1-[4-(2-butyl-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazino]-1-ethanone

IUPAC name

1-(4-{5-butyl-11-methyl-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraen-3-yl}piperazin-1-yl)ethan-1-one

SMILES

CCCCc1nc(N(CC2)CCN2C(C)=O)c(c(CCC(C)C2)c2s2)c2n1

InChI

InChI=1S/C21H30N4OS/c1-4-5-6-18-22-20(25-11-9-24(10-12-25)15(3)26)19-16-8-7-14(2)13-17(16)27-21(19)23-18/h14H,4-13H2,1-3H3/t14-/m1/s1

InChI Key

WNGGCDYEDZJEBC-CQSZACIVSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.243

Distribution Coefficient, logD

4.892

Water Solubility, LogSw

-4.98

Polar Surface Area

41.406

Acid Dissociation Constant (pKa)

22.62

Base Dissociation Constant (pKb)

7.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

References: we are preparing a list of scientific research reports with V029-6104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-6104?
Check Price and Availability of V029-6104, 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 V029-6104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-6104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-6104
  • 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 V029-6104 available by request