V016-5423 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]cyclopropanecarboxamide

V016-5423 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]cyclopropanecarboxamide
V016-5423 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-5423
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]cyclopropanecarboxamide

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

V016-5423

Molecular Formula

C26H28ClN5O3 (C26 H28 ClN5 O3)

Compound Name

N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]cyclopropanecarboxamide

IUPAC name

N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]cyclopropanecarboxamide

SMILES

O=C(CN(Cc1ccco1)C(C1CC1)=O)N(CCC1)CCN1c(cc1)nnc1-c(cccc1)c1Cl

InChI

InChI=1S/C26H28ClN5O3/c27-22-7-2-1-6-21(22)23-10-11-24(29-28-23)30-12-4-13-31(15-14-30)25(33)18-32(26(34)19-8-9-19)17-20-5-3-16-35-20/h1-3,5-7,10-11,16,19H,4,8-9,12-15,17-18H2

InChI Key

CKSZLXFNTZVLPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19836735

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

493.99

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.531

Distribution Coefficient, logD

3.525

Water Solubility, LogSw

-3.89

Polar Surface Area

65.369

Acid Dissociation Constant (pKa)

21.75

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with V016-5423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-5423?
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What is the minimum amount of V016-5423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-5423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-5423
  • 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 V016-5423 available by request