E005-0412 Screening compound: N-(4-fluorophenyl)-2-{4-methyl-2-oxo-2H,6H-pyrimido[1,2-b]indazol-6-yl}propanamide

E005-0412 Screening compound: N-(4-fluorophenyl)-2-{4-methyl-2-oxo-2H,6H-pyrimido[1,2-b]indazol-6-yl}propanamide
E005-0412 Screening compound: N-(4-fluorophenyl)-2-{4-methyl-2-oxo-2H,6H-pyrimido[1,2-b]indazol-6-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E005-0412
N-(4-fluorophenyl)-2-{4-methyl-2-oxo-2H,6H-pyrimido[1,2-b]indazol-6-yl}propanamide

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

E005-0412

Molecular Formula

C20H17FN4O2 (C20 H17 FN4 O2)

Compound Name

N-(4-fluorophenyl)-2-{4-methyl-2-oxo-2H,6H-pyrimido[1,2-b]indazol-6-yl}propanamide

IUPAC name

N-(4-fluorophenyl)-2-{4-methyl-2-oxo-2H6H-pyrimido[12-b]indazol-6-yl}propanamide

SMILES

CC(C(Nc(cc1)ccc1F)=O)N(c(cccc1)c1C1=N2)N1C(C)=CC2=O

InChI

InChI=1S/C20H17FN4O2/c1-12-11-18(26)23-19-16-5-3-4-6-17(16)25(24(12)19)13(2)20(27)22-15-9-7-14(21)8-10-15/h3-11,13H,1-2H3,(H,22,27)/t13-/m0/s1

InChI Key

PGRAVGXCTQCGCM-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD14836409

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.508

Distribution Coefficient, logD

2.508

Water Solubility, LogSw

-3.14

Polar Surface Area

51.115

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with E005-0412 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E005-0412?
Check Price and Availability of E005-0412, 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 E005-0412 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E005-0412
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E005-0412
  • 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 E005-0412 available by request