V026-4751 Screening compound: N-(cyclopropylmethyl)-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide

V026-4751 Screening compound: N-(cyclopropylmethyl)-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide
V026-4751 Screening compound: N-(cyclopropylmethyl)-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-4751
N-(cyclopropylmethyl)-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide

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

V026-4751

Molecular Formula

C27H37N5O3 (C27 H37 N5 O3)

Compound Name

N-(cyclopropylmethyl)-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide

IUPAC name

N-(cyclopropylmethyl)-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-14-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide

SMILES

CC(C)CC(N(CC1CC1)CC(N(CCC1)CCN1c(cc1)nnc1-c(cc1)ccc1OC)=O)=O

InChI

InChI=1S/C27H37N5O3/c1-20(2)17-26(33)32(18-21-5-6-21)19-27(34)31-14-4-13-30(15-16-31)25-12-11-24(28-29-25)22-7-9-23(35-3)10-8-22/h7-12,20-21H,4-6,13-19H2,1-3H3

InChI Key

HPPHCNARORTDOW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19834840

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

479.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.846

Distribution Coefficient, logD

3.842

Water Solubility, LogSw

-3.99

Polar Surface Area

64.908

Acid Dissociation Constant (pKa)

24.23

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

References: we are preparing a list of scientific research reports with V026-4751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-4751?
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What is the minimum amount of V026-4751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-4751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-4751
  • 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 V026-4751 available by request