8010-3642 Screening compound: 4-{6-amino-5-cyano-3-phenyl-1H,4H-pyrano[2,3-c]pyrazol-4-yl}-2-methoxyphenyl morpholine-4-carboxylate

8010-3642 Screening compound: 4-{6-amino-5-cyano-3-phenyl-1H,4H-pyrano[2,3-c]pyrazol-4-yl}-2-methoxyphenyl morpholine-4-carboxylate
8010-3642 Screening compound: 4-{6-amino-5-cyano-3-phenyl-1H,4H-pyrano[2,3-c]pyrazol-4-yl}-2-methoxyphenyl morpholine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-3642
4-{6-amino-5-cyano-3-phenyl-1H,4H-pyrano[2,3-c]pyrazol-4-yl}-2-methoxyphenyl morpholine-4-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

8010-3642

Molecular Formula

C25H23N5O5 (C25 H23 N5 O5)

Compound Name

4-{6-amino-5-cyano-3-phenyl-1H,4H-pyrano[2,3-c]pyrazol-4-yl}-2-methoxyphenyl morpholine-4-carboxylate

IUPAC name

4-{6-amino-5-cyano-3-phenyl-1H4H-pyrano[23-c]pyrazol-4-yl}-2-methoxyphenyl morpholine-4-carboxylate

SMILES

COc(cc(C1C(C#N)=C(N)Oc2c1c(-c1ccccc1)n[nH]2)cc1)c1OC(N1CCOCC1)=O

InChI

InChI=1S/C25H23N5O5/c1-32-19-13-16(7-8-18(19)34-25(31)30-9-11-33-12-10-30)20-17(14-26)23(27)35-24-21(20)22(28-29-24)15-5-3-2-4-6-15/h2-8,13,20H,9-12,27H2,1H3,(H,28,29)/t20-/m0/s1

InChI Key

DEFGMEAIIWQGES-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD01872028

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.484

Distribution Coefficient, logD

2.484

Water Solubility, LogSw

-3.06

Polar Surface Area

108.695

Acid Dissociation Constant (pKa)

12.05

Base Dissociation Constant (pKb)

-1.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with 8010-3642 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-3642?
Check Price and Availability of 8010-3642, 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 8010-3642 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-3642
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-3642
  • 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 8010-3642 available by request