V020-9674 Screening compound: 1-({1-benzyl-2-[(2-fluorophenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-1-(cyclopropylmethyl)-3-ethylthiourea

V020-9674 Screening compound: 1-({1-benzyl-2-[(2-fluorophenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-1-(cyclopropylmethyl)-3-ethylthiourea
V020-9674 Screening compound: 1-({1-benzyl-2-[(2-fluorophenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-1-(cyclopropylmethyl)-3-ethylthiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9674
1-({1-benzyl-2-[(2-fluorophenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-1-(cyclopropylmethyl)-3-ethylthiourea

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

V020-9674

Molecular Formula

C25H29FN4O2S2 (C25 H29 FN4 O2 S2)

Compound Name

1-({1-benzyl-2-[(2-fluorophenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-1-(cyclopropylmethyl)-3-ethylthiourea

IUPAC name

1-({1-benzyl-2-[(2-fluorophenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-1-(cyclopropylmethyl)-3-ethylthiourea

SMILES

CCNC(N(CC1CC1)Cc(n1Cc2ccccc2)cnc1S(Cc(cccc1)c1F)(=O)=O)=S

InChI

InChI=1S/C25H29FN4O2S2/c1-2-27-24(33)29(15-20-12-13-20)17-22-14-28-25(30(22)16-19-8-4-3-5-9-19)34(31,32)18-21-10-6-7-11-23(21)26/h3-11,14,20H,2,12-13,15-18H2,1H3,(H,27,33)

InChI Key

WLTXIKBGOUXWDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19826194

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

500.66

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

4.747

Distribution Coefficient, logD

4.747

Water Solubility, LogSw

-4.37

Polar Surface Area

52.584

Acid Dissociation Constant (pKa)

17.87

Base Dissociation Constant (pKb)

-0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

V020-9674 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V020-9674 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9674?
Check Price and Availability of V020-9674, 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 V020-9674 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9674
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9674
  • 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 V020-9674 available by request