V028-2901 Screening compound: 3,3-dimethyl-N-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)butanamide

V028-2901 Screening compound: 3,3-dimethyl-N-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)butanamide
V028-2901 Screening compound: 3,3-dimethyl-N-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-2901
3,3-dimethyl-N-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)butanamide

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

V028-2901

Molecular Formula

C25H37N3O3S (C25 H37 N3 O3 S)

Compound Name

3,3-dimethyl-N-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)butanamide

IUPAC name

33-dimethyl-N-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)butanamide

SMILES

CC(C)Cn1c(S(Cc2cc(C)ccc2)(=O)=O)ncc1CN(CC=C)C(CC(C)(C)C)=O

InChI

InChI=1S/C25H37N3O3S/c1-8-12-27(23(29)14-25(5,6)7)17-22-15-26-24(28(22)16-19(2)3)32(30,31)18-21-11-9-10-20(4)13-21/h8-11,13,15,19H,1,12,14,16-18H2,2-7H3

InChI Key

SELZOJZYUDODJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19820348

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

459.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.423

Distribution Coefficient, logD

5.423

Water Solubility, LogSw

-5.24

Polar Surface Area

56.857

Acid Dissociation Constant (pKa)

20.02

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.00

V028-2901 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V028-2901 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-2901?
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What is the minimum amount of V028-2901 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-2901
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-2901
  • 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 V028-2901 available by request