D308-0388 Screening compound: methyl 4-[({5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)methyl]benzoate

D308-0388 Screening compound: methyl 4-[({5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)methyl]benzoate
D308-0388 Screening compound: methyl 4-[({5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)methyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D308-0388
methyl 4-[({5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)methyl]benzoate

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

D308-0388

Molecular Formula

C20H17N3O2S (C20 H17 N3 O2 S)

Compound Name

methyl 4-[({5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)methyl]benzoate

IUPAC name

methyl 4-[({5-methyl-[124]triazolo[43-a]quinolin-1-yl}sulfanyl)methyl]benzoate

SMILES

Cc(c(cccc1)c1n12)cc2nnc1SCc(cc1)ccc1C(OC)=O

InChI

InChI=1S/C20H17N3O2S/c1-13-11-18-21-22-20(23(18)17-6-4-3-5-16(13)17)26-12-14-7-9-15(10-8-14)19(24)25-2/h3-11H,12H2,1-2H3

InChI Key

LAWDQDBCLMSUOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04657289

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.379

Distribution Coefficient, logD

4.379

Water Solubility, LogSw

-4.33

Polar Surface Area

42.256

Acid Dissociation Constant (pKa)

23.75

Base Dissociation Constant (pKb)

1.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with D308-0388 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D308-0388?
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What is the minimum amount of D308-0388 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D308-0388
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D308-0388
  • 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 D308-0388 available by request