E005-0554 Screening compound: N-{2-[ethyl(phenyl)amino]ethyl}-2-{4-methyl-2-oxo-2H,6H-pyrimido[1,2-b]indazol-6-yl}propanamide

E005-0554 Screening compound: N-{2-[ethyl(phenyl)amino]ethyl}-2-{4-methyl-2-oxo-2H,6H-pyrimido[1,2-b]indazol-6-yl}propanamide
E005-0554 Screening compound: N-{2-[ethyl(phenyl)amino]ethyl}-2-{4-methyl-2-oxo-2H,6H-pyrimido[1,2-b]indazol-6-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E005-0554
N-{2-[ethyl(phenyl)amino]ethyl}-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

E005-0554

Molecular Formula

C24H27N5O2 (C24 H27 N5 O2)

Compound Name

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

IUPAC name

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

SMILES

CCN(CCNC(C(C)N(c(cccc1)c1C1=N2)N1C(C)=CC2=O)=O)c1ccccc1

InChI

InChI=1S/C24H27N5O2/c1-4-27(19-10-6-5-7-11-19)15-14-25-24(31)18(3)29-21-13-9-8-12-20(21)23-26-22(30)16-17(2)28(23)29/h5-13,16,18H,4,14-15H2,1-3H3,(H,25,31)/t18-/m0/s1

InChI Key

KIUBAQWIAFQXSO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14836464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.645

Distribution Coefficient, logD

2.639

Water Solubility, LogSw

-3.43

Polar Surface Area

55.269

Acid Dissociation Constant (pKa)

14.95

Base Dissociation Constant (pKb)

5.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with E005-0554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E005-0554?
Check Price and Availability of E005-0554, 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 E005-0554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E005-0554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E005-0554
  • 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 E005-0554 available by request