V024-6504 Screening compound: N-cyclohexyl-N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenylpropanamide

V024-6504 Screening compound: N-cyclohexyl-N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenylpropanamide
V024-6504 Screening compound: N-cyclohexyl-N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-6504
N-cyclohexyl-N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenylpropanamide

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

V024-6504

Molecular Formula

C30H35FN2O2S (C30 H35 FN2 O2 S)

Compound Name

N-cyclohexyl-N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenylpropanamide

IUPAC name

N-cyclohexyl-N-({[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenylpropanamide

SMILES

Cc1ccc(CN(Cc(cc2)ccc2F)C(CN(C2CCCCC2)C(CCc2ccccc2)=O)=O)s1

InChI

InChI=1S/C30H35FN2O2S/c1-23-12-18-28(36-23)21-32(20-25-13-16-26(31)17-14-25)30(35)22-33(27-10-6-3-7-11-27)29(34)19-15-24-8-4-2-5-9-24/h2,4-5,8-9,12-14,16-18,27H,3,6-7,10-11,15,19-22H2,1H3

InChI Key

IHLUQZWURGRUDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19763391

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.68

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.485

Distribution Coefficient, logD

6.485

Water Solubility, LogSw

-5.53

Polar Surface Area

31.597

Acid Dissociation Constant (pKa)

23.18

Base Dissociation Constant (pKb)

-1.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V024-6504 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CORONAVIRUS Library (20774 compounds)

MCL1 Targeted Library (12200 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V024-6504 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-6504?
Check Price and Availability of V024-6504, 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 V024-6504 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-6504
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-6504
  • 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 V024-6504 available by request