V007-5687 Screening compound: 4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide

V007-5687 Screening compound: 4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
V007-5687 Screening compound: 4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-5687
4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)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

V007-5687

Molecular Formula

C32H31ClFN5O3 (C32 H31 ClFN5 O3)

Compound Name

4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide

IUPAC name

4-chloro-N-[(4-fluorophenyl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)benzamide

SMILES

COc1cccc(-c(cc2)nnc2N(CCC2)CCN2C(CN(Cc(cc2)ccc2F)C(c(cc2)ccc2Cl)=O)=O)c1

InChI

InChI=1S/C32H31ClFN5O3/c1-42-28-5-2-4-25(20-28)29-14-15-30(36-35-29)37-16-3-17-38(19-18-37)31(40)22-39(21-23-6-12-27(34)13-7-23)32(41)24-8-10-26(33)11-9-24/h2,4-15,20H,3,16-19,21-22H2,1H3

InChI Key

VPZJXKGZDSJGHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19833528

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

588.08

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.887

Distribution Coefficient, logD

4.717

Water Solubility, LogSw

-5.09

Polar Surface Area

64.640

Acid Dissociation Constant (pKa)

22.66

Base Dissociation Constant (pKb)

7.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V007-5687 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-5687?
Check Price and Availability of V007-5687, 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 V007-5687 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-5687
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-5687
  • 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 V007-5687 available by request