V024-2271 Screening compound: 1-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-1-(prop-2-en-1-yl)-3-(propan-2-yl)thiourea

V024-2271 Screening compound: 1-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-1-(prop-2-en-1-yl)-3-(propan-2-yl)thiourea
V024-2271 Screening compound: 1-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-1-(prop-2-en-1-yl)-3-(propan-2-yl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-2271
1-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-1-(prop-2-en-1-yl)-3-(propan-2-yl)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

V024-2271

Molecular Formula

C22H27F3N4O2S2 (C22 H27 F3 N4 O2 S2)

Compound Name

1-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-1-(prop-2-en-1-yl)-3-(propan-2-yl)thiourea

IUPAC name

1-[(1-cyclopropyl-2-{[3-(trifluoromethyl)phenyl]methanesulfonyl}-1H-imidazol-5-yl)methyl]-1-(prop-2-en-1-yl)-3-(propan-2-yl)thiourea

SMILES

CC(C)NC(N(CC=C)Cc(n1C2CC2)cnc1S(Cc1cc(C(F)(F)F)ccc1)(=O)=O)=S

InChI

InChI=1S/C22H27F3N4O2S2/c1-4-10-28(20(32)27-15(2)3)13-19-12-26-21(29(19)18-8-9-18)33(30,31)14-16-6-5-7-17(11-16)22(23,24)25/h4-7,11-12,15,18H,1,8-10,13-14H2,2-3H3,(H,27,32)

InChI Key

VEOPTZRPPVOGJX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19817253

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

500.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.327

Distribution Coefficient, logD

4.327

Water Solubility, LogSw

-4.25

Polar Surface Area

52.566

Acid Dissociation Constant (pKa)

18.01

Base Dissociation Constant (pKb)

-1.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

V024-2271 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 V024-2271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-2271?
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What is the minimum amount of V024-2271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-2271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-2271
  • 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 V024-2271 available by request