V020-9251 Screening compound: 2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-pentyl-1,3-thiazole-4-carboxamide

V020-9251 Screening compound: 2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-pentyl-1,3-thiazole-4-carboxamide
V020-9251 Screening compound: 2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-pentyl-1,3-thiazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9251
2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-pentyl-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

V020-9251

Molecular Formula

C31H43N3O3S (C31 H43 N3 O3 S)

Compound Name

2-({[(4-tert-butylphenyl)methyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-N-pentyl-1,3-thiazole-4-carboxamide

IUPAC name

2-({[(4-tert-butylphenyl)methyl][2-(34-dimethoxyphenyl)ethyl]amino}methyl)-N-pentyl-13-thiazole-4-carboxamide

SMILES

CCCCCNC(c1csc(CN(CCc(cc2)cc(OC)c2OC)Cc2ccc(C(C)(C)C)cc2)n1)=O

InChI

InChI=1S/C31H43N3O3S/c1-7-8-9-17-32-30(35)26-22-38-29(33-26)21-34(20-24-10-13-25(14-11-24)31(2,3)4)18-16-23-12-15-27(36-5)28(19-23)37-6/h10-15,19,22H,7-9,16-18,20-21H2,1-6H3,(H,32,35)

InChI Key

ANIOKMPCNXNONQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19760050

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

537.77

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.894

Distribution Coefficient, logD

6.894

Water Solubility, LogSw

-5.46

Polar Surface Area

53.945

Acid Dissociation Constant (pKa)

14.34

Base Dissociation Constant (pKb)

4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.40

References: we are preparing a list of scientific research reports with V020-9251 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9251?
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What is the minimum amount of V020-9251 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9251
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9251
  • 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 V020-9251 available by request