V007-3258 Screening compound: 2-({[(3-chlorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-(1,2-diphenylethyl)-1,3-thiazole-4-carboxamide

V007-3258 Screening compound: 2-({[(3-chlorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-(1,2-diphenylethyl)-1,3-thiazole-4-carboxamide
V007-3258 Screening compound: 2-({[(3-chlorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-(1,2-diphenylethyl)-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-3258
2-({[(3-chlorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-(1,2-diphenylethyl)-1,3-thiazole-4-carboxamide

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

V007-3258

Molecular Formula

C34H29ClF3N3OS (C34 H29 ClF3 N3 OS)

Compound Name

2-({[(3-chlorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-(1,2-diphenylethyl)-1,3-thiazole-4-carboxamide

IUPAC name

2-({[(3-chlorophenyl)methyl]({[3-(trifluoromethyl)phenyl]methyl})amino}methyl)-N-(12-diphenylethyl)-13-thiazole-4-carboxamide

SMILES

O=C(c1csc(CN(Cc2cc(C(F)(F)F)ccc2)Cc2cccc(Cl)c2)n1)NC(Cc1ccccc1)c1ccccc1

InChI

InChI=1S/C34H29ClF3N3OS/c35-29-16-8-12-26(18-29)21-41(20-25-11-7-15-28(17-25)34(36,37)38)22-32-39-31(23-43-32)33(42)40-30(27-13-5-2-6-14-27)19-24-9-3-1-4-10-24/h1-18,23,30H,19-22H2,(H,40,42)/t30-/m0/s1

InChI Key

JIZDTBAJXIGGBU-PMERELPUSA-N

MDL Number (MFCD)

MFCD19768241

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

620.14

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.338

Distribution Coefficient, logD

8.338

Water Solubility, LogSw

-6.76

Polar Surface Area

37.951

Acid Dissociation Constant (pKa)

11.73

Base Dissociation Constant (pKb)

2.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.65

V007-3258 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with V007-3258 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-3258?
Check Price and Availability of V007-3258, 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 V007-3258 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-3258
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-3258
  • 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 V007-3258 available by request