6173-0230 Screening compound: (E)-N'-(3,5-dimethoxyphenyl)-N-(4,6-dimethylpyrimidin-2-yl)-N''-phenylmethanesulfonylguanidine

6173-0230 Screening compound: (E)-N'-(3,5-dimethoxyphenyl)-N-(4,6-dimethylpyrimidin-2-yl)-N''-phenylmethanesulfonylguanidine
6173-0230 Screening compound: (E)-N'-(3,5-dimethoxyphenyl)-N-(4,6-dimethylpyrimidin-2-yl)-N''-phenylmethanesulfonylguanidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6173-0230
(E)-N'-(3,5-dimethoxyphenyl)-N-(4,6-dimethylpyrimidin-2-yl)-N''-phenylmethanesulfonylguanidine

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

6173-0230

Molecular Formula

C22H25N5O4S (C22 H25 N5 O4 S)

Compound Name

(E)-N'-(3,5-dimethoxyphenyl)-N-(4,6-dimethylpyrimidin-2-yl)-N''-phenylmethanesulfonylguanidine

IUPAC name

(E)-N'-(35-dimethoxyphenyl)-N-(46-dimethylpyrimidin-2-yl)-N''-phenylmethanesulfonylguanidine

SMILES

Cc1nc(N/C(/Nc2cc(OC)cc(OC)c2)=N/S(Cc2ccccc2)(=O)=O)nc(C)c1

InChI

InChI=1S/C22H25N5O4S/c1-15-10-16(2)24-21(23-15)26-22(25-18-11-19(30-3)13-20(12-18)31-4)27-32(28,29)14-17-8-6-5-7-9-17/h5-13H,14H2,1-4H3,(H2,23,24,25,26,27)

InChI Key

BDKRFNXGJSZFDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04014740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.330

Distribution Coefficient, logD

3.329

Water Solubility, LogSw

-3.72

Polar Surface Area

93.864

Acid Dissociation Constant (pKa)

11.09

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with 6173-0230 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6173-0230?
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What is the minimum amount of 6173-0230 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6173-0230
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6173-0230
  • 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 6173-0230 available by request