Y041-1946 Screening compound: 4,7-dimethyl-2-oxo-2H-chromen-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate

Y041-1946 Screening compound: 4,7-dimethyl-2-oxo-2H-chromen-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate
Y041-1946 Screening compound: 4,7-dimethyl-2-oxo-2H-chromen-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-1946
4,7-dimethyl-2-oxo-2H-chromen-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate

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

Y041-1946

Molecular Formula

C25H27NO6 (C25 H27 NO6)

Compound Name

4,7-dimethyl-2-oxo-2H-chromen-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate

IUPAC name

47-dimethyl-2-oxo-2H-chromen-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate

SMILES

Cc1cc(OC(C=C2C)=O)c2c(OC(CCCCCNC(OCc2ccccc2)=O)=O)c1

InChI

InChI=1S/C25H27NO6/c1-17-13-20(24-18(2)15-23(28)32-21(24)14-17)31-22(27)11-7-4-8-12-26-25(29)30-16-19-9-5-3-6-10-19/h3,5-6,9-10,13-15H,4,7-8,11-12,16H2,1-2H3,(H,26,29)

InChI Key

UOFOTZKKFUAGAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03850773

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.573

Distribution Coefficient, logD

4.573

Water Solubility, LogSw

-4.71

Polar Surface Area

73.498

Acid Dissociation Constant (pKa)

14.47

Base Dissociation Constant (pKb)

0.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with Y041-1946 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-1946?
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What is the minimum amount of Y041-1946 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-1946
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-1946
  • 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 Y041-1946 available by request