V017-3079 Screening compound: 2-[(benzylcarbamoyl)(3-methoxypropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(thiophen-2-yl)methyl]acetamide

V017-3079 Screening compound: 2-[(benzylcarbamoyl)(3-methoxypropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(thiophen-2-yl)methyl]acetamide
V017-3079 Screening compound: 2-[(benzylcarbamoyl)(3-methoxypropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(thiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-3079
2-[(benzylcarbamoyl)(3-methoxypropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(thiophen-2-yl)methyl]acetamide

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

V017-3079

Molecular Formula

C26H30FN3O3S (C26 H30 FN3 O3 S)

Compound Name

2-[(benzylcarbamoyl)(3-methoxypropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(thiophen-2-yl)methyl]acetamide

IUPAC name

2-[(benzylcarbamoyl)(3-methoxypropyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(thiophen-2-yl)methyl]acetamide

SMILES

COCCCN(CC(N(Cc1cccs1)Cc(cc1)ccc1F)=O)C(NCc1ccccc1)=O

InChI

InChI=1S/C26H30FN3O3S/c1-33-15-6-14-29(26(32)28-17-21-7-3-2-4-8-21)20-25(31)30(19-24-9-5-16-34-24)18-22-10-12-23(27)13-11-22/h2-5,7-13,16H,6,14-15,17-20H2,1H3,(H,28,32)

InChI Key

DMBVCUDNVQPJIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19750687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.61

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.632

Distribution Coefficient, logD

3.632

Water Solubility, LogSw

-3.70

Polar Surface Area

51.615

Acid Dissociation Constant (pKa)

14.53

Base Dissociation Constant (pKb)

-1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

V017-3079 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V017-3079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-3079?
Check Price and Availability of V017-3079, 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 V017-3079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-3079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-3079
  • 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 V017-3079 available by request