V027-2458 Screening compound: 1-(4-methoxyphenyl)-3-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-3-(2-methylpropyl)thiourea

V027-2458 Screening compound: 1-(4-methoxyphenyl)-3-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-3-(2-methylpropyl)thiourea
V027-2458 Screening compound: 1-(4-methoxyphenyl)-3-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-3-(2-methylpropyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-2458
1-(4-methoxyphenyl)-3-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-3-(2-methylpropyl)thiourea

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

V027-2458

Molecular Formula

C28H38N4O3S2 (C28 H38 N4 O3 S2)

Compound Name

1-(4-methoxyphenyl)-3-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-3-(2-methylpropyl)thiourea

IUPAC name

1-(4-methoxyphenyl)-3-({2-[(3-methylphenyl)methanesulfonyl]-1-(2-methylpropyl)-1H-imidazol-5-yl}methyl)-3-(2-methylpropyl)thiourea

SMILES

CC(C)CN(Cc(n1CC(C)C)cnc1S(Cc1cc(C)ccc1)(=O)=O)C(Nc(cc1)ccc1OC)=S

InChI

InChI=1S/C28H38N4O3S2/c1-20(2)16-31(27(36)30-24-10-12-26(35-6)13-11-24)18-25-15-29-28(32(25)17-21(3)4)37(33,34)19-23-9-7-8-22(5)14-23/h7-15,20-21H,16-19H2,1-6H3,(H,30,36)

InChI Key

WIGHUFXPDBJFAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19826183

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

542.77

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.614

Distribution Coefficient, logD

6.614

Water Solubility, LogSw

-5.66

Polar Surface Area

58.928

Acid Dissociation Constant (pKa)

14.95

Base Dissociation Constant (pKb)

4.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

V027-2458 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 V027-2458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-2458?
Check Price and Availability of V027-2458, 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 V027-2458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-2458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-2458
  • 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 V027-2458 available by request