V029-8115 Screening compound: 3-methyl-N-({2-[(2-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)butanamide

V029-8115 Screening compound: 3-methyl-N-({2-[(2-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)butanamide
V029-8115 Screening compound: 3-methyl-N-({2-[(2-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 V029-8115
3-methyl-N-({2-[(2-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

V029-8115

Molecular Formula

C24H35N3O3S (C24 H35 N3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)CC(N(CC=C)Cc(n1CC(C)C)cnc1S(Cc1c(C)cccc1)(=O)=O)=O

InChI

InChI=1S/C24H35N3O3S/c1-7-12-26(23(28)13-18(2)3)16-22-14-25-24(27(22)15-19(4)5)31(29,30)17-21-11-9-8-10-20(21)6/h7-11,14,18-19H,1,12-13,15-17H2,2-6H3

InChI Key

RAUPDFVCEXYUAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19820295

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

445.63

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

5.039

Distribution Coefficient, logD

5.039

Water Solubility, LogSw

-4.48

Polar Surface Area

56.857

Acid Dissociation Constant (pKa)

19.66

Base Dissociation Constant (pKb)

-1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

V029-8115 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 V029-8115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-8115?
Check Price and Availability of V029-8115, 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 V029-8115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-8115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-8115
  • 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 V029-8115 available by request