V011-5021 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxy-N-(2-methoxyethyl)benzamide

V011-5021 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxy-N-(2-methoxyethyl)benzamide
V011-5021 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxy-N-(2-methoxyethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-5021
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxy-N-(2-methoxyethyl)benzamide

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

V011-5021

Molecular Formula

C28H32ClN5O4 (C28 H32 ClN5 O4)

Compound Name

N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxy-N-(2-methoxyethyl)benzamide

IUPAC name

N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)-3-methoxy-N-(2-methoxyethyl)benzamide

SMILES

COCCN(CC(N(CCC1)CCN1c(cc1)nnc1-c(cccc1)c1Cl)=O)C(c1cc(OC)ccc1)=O

InChI

InChI=1S/C28H32ClN5O4/c1-37-18-17-34(28(36)21-7-5-8-22(19-21)38-2)20-27(35)33-14-6-13-32(15-16-33)26-12-11-25(30-31-26)23-9-3-4-10-24(23)29/h3-5,7-12,19H,6,13-18,20H2,1-2H3

InChI Key

JNELQBKPAVUITF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19831340

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

538.05

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.099

Distribution Coefficient, logD

3.093

Water Solubility, LogSw

-3.65

Polar Surface Area

73.233

Acid Dissociation Constant (pKa)

23.05

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.71

References: we are preparing a list of scientific research reports with V011-5021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-5021?
Check Price and Availability of V011-5021, 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 V011-5021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-5021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-5021
  • 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 V011-5021 available by request