L462-0038 Screening compound: 1,3-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidine-2,4-dione

L462-0038 Screening compound: 1,3-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidine-2,4-dione
L462-0038 Screening compound: 1,3-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound L462-0038
1,3-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidine-2,4-dione

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

L462-0038

Molecular Formula

C22H27N5O3 (C22 H27 N5 O3)

Compound Name

1,3-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidine-2,4-dione

IUPAC name

13-diethyl-7-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1H2H3H4H7H-pyrrolo[23-d]pyrimidine-24-dione

SMILES

CCN(c(n(CC(N(CC1)CCN1c1ccccc1)=O)cc1)c1C(N1CC)=O)C1=O

InChI

InChI=1S/C22H27N5O3/c1-3-26-20-18(21(29)27(4-2)22(26)30)10-11-25(20)16-19(28)24-14-12-23(13-15-24)17-8-6-5-7-9-17/h5-11H,3-4,12-16H2,1-2H3

InChI Key

XELZGJBLDULGGR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27254235

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.259

Distribution Coefficient, logD

2.258

Water Solubility, LogSw

-2.78

Polar Surface Area

53.255

Acid Dissociation Constant (pKa)

23.81

Base Dissociation Constant (pKb)

3.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with L462-0038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L462-0038?
Check Price and Availability of L462-0038, 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 L462-0038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L462-0038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L462-0038
  • 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 L462-0038 available by request