V015-5419 Screening compound: 2-phenethyl-4-piperidino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

V015-5419 Screening compound: 2-phenethyl-4-piperidino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
V015-5419 Screening compound: 2-phenethyl-4-piperidino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-5419
2-phenethyl-4-piperidino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

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

V015-5419

Molecular Formula

C23H27N3S (C23 H27 N3 S)

Compound Name

2-phenethyl-4-piperidino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

IUPAC name

5-(2-phenylethyl)-3-(piperidin-1-yl)-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraene

SMILES

C(Cc1nc(N2CCCCC2)c(c(CCCC2)c2s2)c2n1)c1ccccc1

InChI

InChI=1S/C23H27N3S/c1-3-9-17(10-4-1)13-14-20-24-22(26-15-7-2-8-16-26)21-18-11-5-6-12-19(18)27-23(21)25-20/h1,3-4,9-10H,2,5-8,11-16H2

InChI Key

JHXVQYMSEOQZEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19844778

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

377.55

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.783

Distribution Coefficient, logD

6.482

Water Solubility, LogSw

-6.42

Polar Surface Area

23.939

Acid Dissociation Constant (pKa)

21.95

Base Dissociation Constant (pKb)

7.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.83

V015-5419 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V015-5419 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-5419?
Check Price and Availability of V015-5419, 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 V015-5419 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-5419
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-5419
  • 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 V015-5419 available by request