V020-9187 Screening compound: ethyl 1-[2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carbonyl]piperidine-3-carboxylate

V020-9187 Screening compound: ethyl 1-[2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carbonyl]piperidine-3-carboxylate
V020-9187 Screening compound: ethyl 1-[2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carbonyl]piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9187
ethyl 1-[2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carbonyl]piperidine-3-carboxylate

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

V020-9187

Molecular Formula

C30H36FN3O5S (C30 H36 FN3 O5 S)

Compound Name

ethyl 1-[2-({[2-(3,4-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-1,3-thiazole-4-carbonyl]piperidine-3-carboxylate

IUPAC name

ethyl 1-[2-({[2-(34-dimethoxyphenyl)ethyl][(4-fluorophenyl)methyl]amino}methyl)-13-thiazole-4-carbonyl]piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1C(c1csc(CN(CCc(cc2)cc(OC)c2OC)Cc(cc2)ccc2F)n1)=O)=O

InChI

InChI=1S/C30H36FN3O5S/c1-4-39-30(36)23-6-5-14-34(18-23)29(35)25-20-40-28(32-25)19-33(17-22-7-10-24(31)11-8-22)15-13-21-9-12-26(37-2)27(16-21)38-3/h7-12,16,20,23H,4-6,13-15,17-19H2,1-3H3/t23-/m0/s1

InChI Key

MSYSZIGXTARUAC-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19760088

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

569.7

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.332

Distribution Coefficient, logD

4.332

Water Solubility, LogSw

-4.28

Polar Surface Area

66.754

Acid Dissociation Constant (pKa)

22.52

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.30

References: we are preparing a list of scientific research reports with V020-9187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9187?
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What is the minimum amount of V020-9187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9187
  • 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 V020-9187 available by request