V013-0618 Screening compound: N-benzyl-2-[1-(4-hexylphenyl)-N-(3-methoxypropyl)formamido]-N-[(thiophen-2-yl)methyl]acetamide

V013-0618 Screening compound: N-benzyl-2-[1-(4-hexylphenyl)-N-(3-methoxypropyl)formamido]-N-[(thiophen-2-yl)methyl]acetamide
V013-0618 Screening compound: N-benzyl-2-[1-(4-hexylphenyl)-N-(3-methoxypropyl)formamido]-N-[(thiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-0618
N-benzyl-2-[1-(4-hexylphenyl)-N-(3-methoxypropyl)formamido]-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

V013-0618

Molecular Formula

C31H40N2O3S (C31 H40 N2 O3 S)

Compound Name

N-benzyl-2-[1-(4-hexylphenyl)-N-(3-methoxypropyl)formamido]-N-[(thiophen-2-yl)methyl]acetamide

IUPAC name

N-benzyl-2-[1-(4-hexylphenyl)-N-(3-methoxypropyl)formamido]-N-[(thiophen-2-yl)methyl]acetamide

SMILES

CCCCCCc(cc1)ccc1C(N(CCCOC)CC(N(Cc1cccs1)Cc1ccccc1)=O)=O

InChI

InChI=1S/C31H40N2O3S/c1-3-4-5-7-12-26-16-18-28(19-17-26)31(35)32(20-11-21-36-2)25-30(34)33(24-29-15-10-22-37-29)23-27-13-8-6-9-14-27/h6,8-10,13-19,22H,3-5,7,11-12,20-21,23-25H2,1-2H3

InChI Key

ICUPOHPNHHKKLO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19754348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.74

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

18.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.613

Distribution Coefficient, logD

6.613

Water Solubility, LogSw

-5.65

Polar Surface Area

41.472

Acid Dissociation Constant (pKa)

21.85

Base Dissociation Constant (pKb)

-2.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.90

References: we are preparing a list of scientific research reports with V013-0618 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-0618?
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What is the minimum amount of V013-0618 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-0618
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-0618
  • 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 V013-0618 available by request