Y040-8101 Screening compound: 6-oxo-6H-benzo[c]chromen-3-yl 2-{[(benzyloxy)carbonyl]amino}propanoate

Y040-8101 Screening compound: 6-oxo-6H-benzo[c]chromen-3-yl 2-{[(benzyloxy)carbonyl]amino}propanoate
Y040-8101 Screening compound: 6-oxo-6H-benzo[c]chromen-3-yl 2-{[(benzyloxy)carbonyl]amino}propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-8101
6-oxo-6H-benzo[c]chromen-3-yl 2-{[(benzyloxy)carbonyl]amino}propanoate

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

Y040-8101

Molecular Formula

C24H19NO6 (C24 H19 NO6)

Compound Name

6-oxo-6H-benzo[c]chromen-3-yl 2-{[(benzyloxy)carbonyl]amino}propanoate

IUPAC name

6-oxo-6H-benzo[c]chromen-3-yl (2S)-2-{[(benzyloxy)carbonyl]amino}propanoate

SMILES

CC(C(Oc(cc1)cc(O2)c1-c(cccc1)c1C2=O)=O)NC(OCc1ccccc1)=O

InChI

InChI=1S/C24H19NO6/c1-15(25-24(28)29-14-16-7-3-2-4-8-16)22(26)30-17-11-12-19-18-9-5-6-10-20(18)23(27)31-21(19)13-17/h2-13,15H,14H2,1H3,(H,25,28)/t15-/m0/s1

InChI Key

MCAZTVREVCMPPG-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD01548014

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.075

Distribution Coefficient, logD

4.075

Water Solubility, LogSw

-5.25

Polar Surface Area

73.571

Acid Dissociation Constant (pKa)

12.79

Base Dissociation Constant (pKb)

-3.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with Y040-8101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-8101?
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What is the minimum amount of Y040-8101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-8101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-8101
  • 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 Y040-8101 available by request