V001-2197 Screening compound: 3-[2-(4-tert-butylphenyl)ethyl]-1-{[2-(3'-ethoxybiphenyl-3-yl)-1,3-thiazol-4-yl]methyl}piperidine

V001-2197 Screening compound: 3-[2-(4-tert-butylphenyl)ethyl]-1-{[2-(3'-ethoxybiphenyl-3-yl)-1,3-thiazol-4-yl]methyl}piperidine
V001-2197 Screening compound: 3-[2-(4-tert-butylphenyl)ethyl]-1-{[2-(3'-ethoxybiphenyl-3-yl)-1,3-thiazol-4-yl]methyl}piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-2197
3-[2-(4-tert-butylphenyl)ethyl]-1-{[2-(3'-ethoxybiphenyl-3-yl)-1,3-thiazol-4-yl]methyl}piperidine

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

V001-2197

Molecular Formula

C35H42N2OS (C35 H42 N2 OS)

Compound Name

3-[2-(4-tert-butylphenyl)ethyl]-1-{[2-(3'-ethoxybiphenyl-3-yl)-1,3-thiazol-4-yl]methyl}piperidine

IUPAC name

n/a

SMILES

CCOc1cccc(-c2cccc(-c3nc(CN4CC(CCc5ccc(C(C)(C)C)cc5)CCC4)cs3)c2)c1

InChI

InChI=1S/C35H42N2OS/c1-5-38-33-13-7-11-29(22-33)28-10-6-12-30(21-28)34-36-32(25-39-34)24-37-20-8-9-27(23-37)15-14-26-16-18-31(19-17-26)35(2,3)4/h6-7,10-13,16-19,21-22,25,27H,5,8-9,14-15,20,23-24H2,1-4H3/t27-/m1/s1

InChI Key

OTAQGNADWZKEKY-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19963566

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

538.8

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

9.596

Distribution Coefficient, logD

9.513

Water Solubility, LogSw

-5.87

Polar Surface Area

20.714

Acid Dissociation Constant (pKa)

23.76

Base Dissociation Constant (pKb)

6.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with V001-2197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-2197?
Check Price and Availability of V001-2197, 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 V001-2197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-2197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-2197
  • 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 V001-2197 available by request