V019-9399 Screening compound: N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-cyclopropylbenzamide

V019-9399 Screening compound: N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-cyclopropylbenzamide
V019-9399 Screening compound: N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-cyclopropylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-9399
N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-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

V019-9399

Molecular Formula

C29H28ClN3O3S (C29 H28 ClN3 O3 S)

Compound Name

N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-cyclopropylbenzamide

IUPAC name

N-({1-benzyl-2-[(2-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-3-chloro-N-cyclopropylbenzamide

SMILES

Cc1c(CS(c2ncc(CN(C3CC3)C(c3cccc(Cl)c3)=O)n2Cc2ccccc2)(=O)=O)cccc1

InChI

InChI=1S/C29H28ClN3O3S/c1-21-8-5-6-11-24(21)20-37(35,36)29-31-17-27(33(29)18-22-9-3-2-4-10-22)19-32(26-14-15-26)28(34)23-12-7-13-25(30)16-23/h2-13,16-17,26H,14-15,18-20H2,1H3

InChI Key

DBJUDILJIKBQCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19829668

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

534.08

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

6.247

Distribution Coefficient, logD

6.247

Water Solubility, LogSw

-6.09

Polar Surface Area

56.167

Acid Dissociation Constant (pKa)

19.66

Base Dissociation Constant (pKb)

-2.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

V019-9399 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 V019-9399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-9399?
Check Price and Availability of V019-9399, 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 V019-9399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-9399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-9399
  • 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 V019-9399 available by request