6220-3852 Screening compound: 2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5,6-dimethyl-1H-1,3-benzodiazole

6220-3852 Screening compound: 2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5,6-dimethyl-1H-1,3-benzodiazole
6220-3852 Screening compound: 2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5,6-dimethyl-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6220-3852
2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5,6-dimethyl-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

6220-3852

Molecular Formula

C20H17FN2S (C20 H17 FN2 S)

Compound Name

2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-5,6-dimethyl-1H-1,3-benzodiazole

IUPAC name

2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-56-dimethyl-1H-13-benzodiazole

SMILES

Cc(c(C)c1)cc([nH]2)c1nc2SCc(c1ccccc11)ccc1F

InChI

InChI=1S/C20H17FN2S/c1-12-9-18-19(10-13(12)2)23-20(22-18)24-11-14-7-8-17(21)16-6-4-3-5-15(14)16/h3-10H,11H2,1-2H3,(H,22,23)

InChI Key

OAZKMTNNFICYHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01429288

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.43

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

6.132

Distribution Coefficient, logD

6.118

Water Solubility, LogSw

-5.88

Polar Surface Area

17.708

Acid Dissociation Constant (pKa)

14.70

Base Dissociation Constant (pKb)

5.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with 6220-3852 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6220-3852?
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What is the minimum amount of 6220-3852 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6220-3852
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6220-3852
  • 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 6220-3852 available by request