V008-5694 Screening compound: 4-chloro-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethylbenzamide

V008-5694 Screening compound: 4-chloro-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethylbenzamide
V008-5694 Screening compound: 4-chloro-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-5694
4-chloro-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethylbenzamide

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

V008-5694

Molecular Formula

C26H27Cl2N5O2 (C26 H27 Cl2 N5 O2)

Compound Name

4-chloro-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethylbenzamide

IUPAC name

4-chloro-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)-N-ethylbenzamide

SMILES

CCN(CC(N(CCC1)CCN1c(cc1)nnc1-c(cccc1)c1Cl)=O)C(c(cc1)ccc1Cl)=O

InChI

InChI=1S/C26H27Cl2N5O2/c1-2-31(26(35)19-8-10-20(27)11-9-19)18-25(34)33-15-5-14-32(16-17-33)24-13-12-23(29-30-24)21-6-3-4-7-22(21)28/h3-4,6-13H,2,5,14-18H2,1H3

InChI Key

SWKVOGGTODYEKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19831362

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

512.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.140

Distribution Coefficient, logD

4.134

Water Solubility, LogSw

-4.49

Polar Surface Area

57.093

Acid Dissociation Constant (pKa)

23.05

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

References: we are preparing a list of scientific research reports with V008-5694 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-5694?
Check Price and Availability of V008-5694, 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 V008-5694 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-5694
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-5694
  • 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 V008-5694 available by request