V015-5089 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenyl-N-(propan-2-yl)propanamide

V015-5089 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenyl-N-(propan-2-yl)propanamide
V015-5089 Screening compound: N-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenyl-N-(propan-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-5089
N-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenyl-N-(propan-2-yl)propanamide

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

V015-5089

Molecular Formula

C28H32N2O4S (C28 H32 N2 O4 S)

Compound Name

N-({[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenyl-N-(propan-2-yl)propanamide

IUPAC name

N-({[(2H-13-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-3-phenyl-N-(propan-2-yl)propanamide

SMILES

CC(C)N(CC(N(Cc1c(C)ccs1)Cc(cc1)cc2c1OCO2)=O)C(CCc1ccccc1)=O

InChI

InChI=1S/C28H32N2O4S/c1-20(2)30(27(31)12-10-22-7-5-4-6-8-22)18-28(32)29(17-26-21(3)13-14-35-26)16-23-9-11-24-25(15-23)34-19-33-24/h4-9,11,13-15,20H,10,12,16-19H2,1-3H3

InChI Key

NSAJXNUKZNHESW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10460604

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.199

Distribution Coefficient, logD

5.199

Water Solubility, LogSw

-5.07

Polar Surface Area

49.483

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

-0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V015-5089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-5089?
Check Price and Availability of V015-5089, 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 V015-5089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-5089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-5089
  • 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 V015-5089 available by request