V020-2452 Screening compound: 3-chloro-N-({1-cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(2-morpholinoethyl)benzamide

V020-2452 Screening compound: 3-chloro-N-({1-cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(2-morpholinoethyl)benzamide
V020-2452 Screening compound: 3-chloro-N-({1-cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(2-morpholinoethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-2452
3-chloro-N-({1-cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(2-morpholinoethyl)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

V020-2452

Molecular Formula

C31H39ClN4O4S (C31 H39 ClN4 O4 S)

Compound Name

3-chloro-N-({1-cyclohexyl-2-[(3-methylbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(2-morpholinoethyl)benzamide

IUPAC name

3-chloro-N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-[2-(morpholin-4-yl)ethyl]benzamide

SMILES

Cc1cccc(CS(c2ncc(CN(CCN3CCOCC3)C(c3cccc(Cl)c3)=O)n2C2CCCCC2)(=O)=O)c1

InChI

InChI=1S/C31H39ClN4O4S/c1-24-7-5-8-25(19-24)23-41(38,39)31-33-21-29(36(31)28-11-3-2-4-12-28)22-35(14-13-34-15-17-40-18-16-34)30(37)26-9-6-10-27(32)20-26/h5-10,19-21,28H,2-4,11-18,22-23H2,1H3

InChI Key

DSCIYESKDWINJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19815971

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

599.19

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.877

Distribution Coefficient, logD

4.871

Water Solubility, LogSw

-4.79

Polar Surface Area

69.037

Acid Dissociation Constant (pKa)

20.02

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.39

References: we are preparing a list of scientific research reports with V020-2452 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-2452?
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What is the minimum amount of V020-2452 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-2452
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-2452
  • 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 V020-2452 available by request