8011-9072 Screening compound: 4-[6-amino-5-cyano-3-(pyridin-4-yl)-1H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-ethoxy-6-nitrophenyl morpholine-4-carboxylate

8011-9072 Screening compound: 4-[6-amino-5-cyano-3-(pyridin-4-yl)-1H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-ethoxy-6-nitrophenyl morpholine-4-carboxylate
8011-9072 Screening compound: 4-[6-amino-5-cyano-3-(pyridin-4-yl)-1H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-ethoxy-6-nitrophenyl morpholine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-9072
4-[6-amino-5-cyano-3-(pyridin-4-yl)-1H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-ethoxy-6-nitrophenyl 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

8011-9072

Molecular Formula

C25H23N7O7 (C25 H23 N7 O7)

Compound Name

4-[6-amino-5-cyano-3-(pyridin-4-yl)-1H,4H-pyrano[2,3-c]pyrazol-4-yl]-2-ethoxy-6-nitrophenyl morpholine-4-carboxylate

IUPAC name

4-[6-amino-5-cyano-3-(pyridin-4-yl)-1H4H-pyrano[23-c]pyrazol-4-yl]-2-ethoxy-6-nitrophenyl morpholine-4-carboxylate

SMILES

CCOc1cc(C2C(C#N)=C(N)Oc3c2c(-c2ccncc2)n[nH]3)cc([N+]([O-])=O)c1OC(N1CCOCC1)=O

InChI

InChI=1S/C25H23N7O7/c1-2-37-18-12-15(11-17(32(34)35)22(18)38-25(33)31-7-9-36-10-8-31)19-16(13-26)23(27)39-24-20(19)21(29-30-24)14-3-5-28-6-4-14/h3-6,11-12,19H,2,7-10,27H2,1H3,(H,29,30)/t19-/m0/s1

InChI Key

DKWXRUTYWIXYEP-IBGZPJMESA-N

MDL Number (MFCD)

MFCD03035408

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.5

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

14

Partition Coefficient, logP

1.455

Distribution Coefficient, logD

1.450

Water Solubility, LogSw

-1.86

Polar Surface Area

150.870

Acid Dissociation Constant (pKa)

11.63

Base Dissociation Constant (pKb)

5.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with 8011-9072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-9072?
Check Price and Availability of 8011-9072, 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 8011-9072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-9072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-9072
  • 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 8011-9072 available by request