Y040-4097 Screening compound: 2-{[(7-hydroxy-4-methyl-2-oxo-2H-chromen-8-yl)methyl]amino}propanoic acid

Y040-4097 Screening compound: 2-{[(7-hydroxy-4-methyl-2-oxo-2H-chromen-8-yl)methyl]amino}propanoic acid
Y040-4097 Screening compound: 2-{[(7-hydroxy-4-methyl-2-oxo-2H-chromen-8-yl)methyl]amino}propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4097
2-{[(7-hydroxy-4-methyl-2-oxo-2H-chromen-8-yl)methyl]amino}propanoic acid

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

Y040-4097

Molecular Formula

C14H15NO5 (C14 H15 NO5)

Compound Name

2-{[(7-hydroxy-4-methyl-2-oxo-2H-chromen-8-yl)methyl]amino}propanoic acid

IUPAC name

(2R)-2-{[(7-hydroxy-4-methyl-2-oxo-2H-chromen-8-yl)methyl]amino}propanoic acid

SMILES

CC(C(O)=O)NCc(c(O1)c(cc2)C(C)=CC1=O)c2O

InChI

InChI=1S/C14H15NO5/c1-7-5-12(17)20-13-9(7)3-4-11(16)10(13)6-15-8(2)14(18)19/h3-5,8,15-16H,6H2,1-2H3,(H,18,19)/t8-/m0/s1

InChI Key

PHJZJPUBGIRGCQ-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD01083155

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.28

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.448

Distribution Coefficient, logD

-2.309

Water Solubility, LogSw

-2.09

Polar Surface Area

76.278

Acid Dissociation Constant (pKa)

2.78

Base Dissociation Constant (pKb)

8.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with Y040-4097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4097?
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What is the minimum amount of Y040-4097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4097
  • 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 Y040-4097 available by request