V024-3188 Screening compound: N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-4-methoxy-N-(prop-2-en-1-yl)benzamide

V024-3188 Screening compound: N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-4-methoxy-N-(prop-2-en-1-yl)benzamide
V024-3188 Screening compound: N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-4-methoxy-N-(prop-2-en-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-3188
N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-4-methoxy-N-(prop-2-en-1-yl)benzamide

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

V024-3188

Molecular Formula

C29H35N3O4S (C29 H35 N3 O4 S)

Compound Name

N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-4-methoxy-N-(prop-2-en-1-yl)benzamide

IUPAC name

N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-4-methoxy-N-(prop-2-en-1-yl)benzamide

SMILES

Cc1cccc(CS(c2ncc(CN(CC=C)C(c(cc3)ccc3OC)=O)n2C2CCCCC2)(=O)=O)c1

InChI

InChI=1S/C29H35N3O4S/c1-4-17-31(28(33)24-13-15-27(36-3)16-14-24)20-26-19-30-29(32(26)25-11-6-5-7-12-25)37(34,35)21-23-10-8-9-22(2)18-23/h4,8-10,13-16,18-19,25H,1,5-7,11-12,17,20-21H2,2-3H3

InChI Key

RHHCBPWGEHEEOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19815794

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

521.68

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.261

Distribution Coefficient, logD

5.261

Water Solubility, LogSw

-4.87

Polar Surface Area

64.961

Acid Dissociation Constant (pKa)

20.02

Base Dissociation Constant (pKb)

-1.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

V024-3188 in Drug Discovery

Included in Screening Libraries

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

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V024-3188 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-3188?
Check Price and Availability of V024-3188, 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 V024-3188 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-3188
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-3188
  • 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 V024-3188 available by request