V001-7799 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-methoxy-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

V001-7799 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-methoxy-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide
V001-7799 Screening compound: N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-methoxy-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-7799
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-methoxy-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

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

V001-7799

Molecular Formula

C28H32ClN5O5S (C28 H32 ClN5 O5 S)

Compound Name

N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-methoxy-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

IUPAC name

N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-4-methoxy-N-[(oxolan-2-yl)methyl]benzene-1-sulfonamide

SMILES

COc(cc1)ccc1S(N(CC1OCCC1)CC(N(CC1)CCN1c(cc1)nnc1-c(cccc1)c1Cl)=O)(=O)=O

InChI

InChI=1S/C28H32ClN5O5S/c1-38-21-8-10-23(11-9-21)40(36,37)34(19-22-5-4-18-39-22)20-28(35)33-16-14-32(15-17-33)27-13-12-26(30-31-27)24-6-2-3-7-25(24)29/h2-3,6-13,22H,4-5,14-20H2,1H3/t22-/m1/s1

InChI Key

YADSRFDESLUDJF-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19825473

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

586.11

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.255

Distribution Coefficient, logD

3.251

Water Solubility, LogSw

-3.70

Polar Surface Area

88.128

Acid Dissociation Constant (pKa)

23.02

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.30

References: we are preparing a list of scientific research reports with V001-7799 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-7799?
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What is the minimum amount of V001-7799 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-7799
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-7799
  • 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 V001-7799 available by request