3565-2379 Screening compound: ethyl 6-amino-5-cyano-4-(2-ethoxyphenyl)-2-methyl-4H-pyran-3-carboxylate

3565-2379 Screening compound: ethyl 6-amino-5-cyano-4-(2-ethoxyphenyl)-2-methyl-4H-pyran-3-carboxylate
3565-2379 Screening compound: ethyl 6-amino-5-cyano-4-(2-ethoxyphenyl)-2-methyl-4H-pyran-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3565-2379
ethyl 6-amino-5-cyano-4-(2-ethoxyphenyl)-2-methyl-4H-pyran-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

3565-2379

Molecular Formula

C18H20N2O4 (C18 H20 N2 O4)

Compound Name

ethyl 6-amino-5-cyano-4-(2-ethoxyphenyl)-2-methyl-4H-pyran-3-carboxylate

IUPAC name

ethyl 6-amino-5-cyano-4-(2-ethoxyphenyl)-2-methyl-4H-pyran-3-carboxylate

SMILES

CCOC(C(C1c(cccc2)c2OCC)=C(C)OC(N)=C1C#N)=O

InChI

InChI=1S/C18H20N2O4/c1-4-22-14-9-7-6-8-12(14)16-13(10-19)17(20)24-11(3)15(16)18(21)23-5-2/h6-9,16H,4-5,20H2,1-3H3/t16-/m1/s1

InChI Key

YKTOYPGUSDUNON-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD00977162

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.737

Distribution Coefficient, logD

2.737

Water Solubility, LogSw

-2.98

Polar Surface Area

74.656

Acid Dissociation Constant (pKa)

13.93

Base Dissociation Constant (pKb)

-0.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 3565-2379 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3565-2379?
Check Price and Availability of 3565-2379, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3565-2379 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3565-2379
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3565-2379
  • 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 3565-2379 available by request