V010-8702 Screening compound: N-({2-[(3-chlorobenzyl)sulfonyl]-1-isopropyl-1H-imidazol-5-yl}methyl)-N-cyclopropyl-4-methyl-1-benzenesulfonamide

V010-8702 Screening compound: N-({2-[(3-chlorobenzyl)sulfonyl]-1-isopropyl-1H-imidazol-5-yl}methyl)-N-cyclopropyl-4-methyl-1-benzenesulfonamide
V010-8702 Screening compound: N-({2-[(3-chlorobenzyl)sulfonyl]-1-isopropyl-1H-imidazol-5-yl}methyl)-N-cyclopropyl-4-methyl-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-8702
N-({2-[(3-chlorobenzyl)sulfonyl]-1-isopropyl-1H-imidazol-5-yl}methyl)-N-cyclopropyl-4-methyl-1-benzenesulfonamide

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

V010-8702

Molecular Formula

C24H28ClN3O4S2 (C24 H28 ClN3 O4 S2)

Compound Name

N-({2-[(3-chlorobenzyl)sulfonyl]-1-isopropyl-1H-imidazol-5-yl}methyl)-N-cyclopropyl-4-methyl-1-benzenesulfonamide

IUPAC name

N-({2-[(3-chlorophenyl)methanesulfonyl]-1-(propan-2-yl)-1H-imidazol-5-yl}methyl)-N-cyclopropyl-4-methylbenzene-1-sulfonamide

SMILES

CC(C)n1c(S(Cc2cccc(Cl)c2)(=O)=O)ncc1CN(C1CC1)S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C24H28ClN3O4S2/c1-17(2)28-22(14-26-24(28)33(29,30)16-19-5-4-6-20(25)13-19)15-27(21-9-10-21)34(31,32)23-11-7-18(3)8-12-23/h4-8,11-14,17,21H,9-10,15-16H2,1-3H3

InChI Key

VLRPEOKVBBYLIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19827201

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

522.09

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.057

Distribution Coefficient, logD

5.057

Water Solubility, LogSw

-5.09

Polar Surface Area

73.716

Acid Dissociation Constant (pKa)

19.63

Base Dissociation Constant (pKb)

-0.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

V010-8702 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V010-8702 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-8702?
Check Price and Availability of V010-8702, 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 V010-8702 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-8702
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-8702
  • 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 V010-8702 available by request