V027-3020 Screening compound: N-({1-benzyl-2-[(4-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-2,4-dichloro-N-cyclopropylbenzamide

V027-3020 Screening compound: N-({1-benzyl-2-[(4-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-2,4-dichloro-N-cyclopropylbenzamide
V027-3020 Screening compound: N-({1-benzyl-2-[(4-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-2,4-dichloro-N-cyclopropylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-3020
N-({1-benzyl-2-[(4-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-2,4-dichloro-N-cyclopropylbenzamide

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

V027-3020

Molecular Formula

C29H27Cl2N3O3S (C29 H27 Cl2 N3 O3 S)

Compound Name

N-({1-benzyl-2-[(4-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-2,4-dichloro-N-cyclopropylbenzamide

IUPAC name

N-({1-benzyl-2-[(4-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-24-dichloro-N-cyclopropylbenzamide

SMILES

Cc1ccc(CS(c2ncc(CN(C3CC3)C(c(ccc(Cl)c3)c3Cl)=O)n2Cc2ccccc2)(=O)=O)cc1

InChI

InChI=1S/C29H27Cl2N3O3S/c1-20-7-9-22(10-8-20)19-38(36,37)29-32-16-25(34(29)17-21-5-3-2-4-6-21)18-33(24-12-13-24)28(35)26-14-11-23(30)15-27(26)31/h2-11,14-16,24H,12-13,17-19H2,1H3

InChI Key

KCSUWMCWTVDDFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19815818

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

568.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.084

Distribution Coefficient, logD

6.084

Water Solubility, LogSw

-6.07

Polar Surface Area

56.167

Acid Dissociation Constant (pKa)

20.02

Base Dissociation Constant (pKb)

-3.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

V027-3020 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 V027-3020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-3020?
Check Price and Availability of V027-3020, 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 V027-3020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-3020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-3020
  • 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 V027-3020 available by request