V017-5212 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)carbamoyl][3-(morpholin-4-yl)propyl]amino}-N-[(furan-2-yl)methyl]acetamide

V017-5212 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)carbamoyl][3-(morpholin-4-yl)propyl]amino}-N-[(furan-2-yl)methyl]acetamide
V017-5212 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)carbamoyl][3-(morpholin-4-yl)propyl]amino}-N-[(furan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-5212
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)carbamoyl][3-(morpholin-4-yl)propyl]amino}-N-[(furan-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

V017-5212

Molecular Formula

C29H32Cl2N4O6 (C29 H32 Cl2 N4 O6)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3,4-dichlorophenyl)carbamoyl][3-(morpholin-4-yl)propyl]amino}-N-[(furan-2-yl)methyl]acetamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-{[(34-dichlorophenyl)carbamoyl][3-(morpholin-4-yl)propyl]amino}-N-[(furan-2-yl)methyl]acetamide

SMILES

O=C(CN(CCCN1CCOCC1)C(Nc(cc1)cc(Cl)c1Cl)=O)N(Cc1ccco1)Cc(cc1)cc2c1OCO2

InChI

InChI=1S/C29H32Cl2N4O6/c30-24-6-5-22(16-25(24)31)32-29(37)34(9-2-8-33-10-13-38-14-11-33)19-28(36)35(18-23-3-1-12-39-23)17-21-4-7-26-27(15-21)41-20-40-26/h1,3-7,12,15-16H,2,8-11,13-14,17-20H2,(H,32,37)

InChI Key

HNYQPRKDXBMPAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19742241

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

603.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.481

Distribution Coefficient, logD

4.362

Water Solubility, LogSw

-4.51

Polar Surface Area

77.416

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

6.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.93

References: we are preparing a list of scientific research reports with V017-5212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-5212?
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What is the minimum amount of V017-5212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-5212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-5212
  • 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 V017-5212 available by request