4327-3194 Screening compound: 1-methyl-2-{[(6-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]methyl}-1H-1,3-benzodiazole

4327-3194 Screening compound: 1-methyl-2-{[(6-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]methyl}-1H-1,3-benzodiazole
4327-3194 Screening compound: 1-methyl-2-{[(6-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]methyl}-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4327-3194
1-methyl-2-{[(6-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]methyl}-1H-1,3-benzodiazole

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

4327-3194

Molecular Formula

C17H16N4S (C17 H16 N4 S)

Compound Name

1-methyl-2-{[(6-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]methyl}-1H-1,3-benzodiazole

IUPAC name

1-methyl-2-{[(6-methyl-1H-13-benzodiazol-2-yl)sulfanyl]methyl}-1H-13-benzodiazole

SMILES

Cc(cc1)cc([nH]2)c1nc2SCc1nc(cccc2)c2n1C

InChI

InChI=1S/C17H16N4S/c1-11-7-8-12-14(9-11)20-17(19-12)22-10-16-18-13-5-3-4-6-15(13)21(16)2/h3-9H,10H2,1-2H3,(H,19,20)

InChI Key

RXVWMCWSJUKTGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02063274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.679

Distribution Coefficient, logD

3.145

Water Solubility, LogSw

-3.89

Polar Surface Area

29.966

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

7.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with 4327-3194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4327-3194?
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What is the minimum amount of 4327-3194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4327-3194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4327-3194
  • 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 4327-3194 available by request