Y508-1444 Screening compound: methyl 2-{[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

Y508-1444 Screening compound: methyl 2-{[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Y508-1444 Screening compound: methyl 2-{[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y508-1444
methyl 2-{[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

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

Y508-1444

Molecular Formula

C17H17BrN2O3S (C17 H17 BrN2 O3 S)

Compound Name

methyl 2-{[(E)-1-(5-bromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

IUPAC name

n/a

SMILES

CN(CC1)Cc2c1c(C(OC)=O)c(/N=C/c(cc(cc1)Br)c1O)s2

InChI

InChI=1S/C17H17BrN2O3S/c1-20-6-5-12-14(9-20)24-16(15(12)17(22)23-2)19-8-10-7-11(18)3-4-13(10)21/h3-4,7-8,21H,5-6,9H2,1-2H3

InChI Key

MMWKBYGDWWNRBD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.608

Distribution Coefficient, logD

3.594

Water Solubility, LogSw

-3.87

Polar Surface Area

49.213

Acid Dissociation Constant (pKa)

8.98

Base Dissociation Constant (pKb)

5.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with Y508-1444 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y508-1444?
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What is the minimum amount of Y508-1444 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y508-1444
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y508-1444
  • 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 Y508-1444 available by request