L462-0468 Screening compound: 2-{1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-7-yl}-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}acetamide

L462-0468 Screening compound: 2-{1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-7-yl}-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}acetamide
L462-0468 Screening compound: 2-{1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-7-yl}-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L462-0468
2-{1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-7-yl}-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}acetamide

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

L462-0468

Molecular Formula

C24H32N6O4 (C24 H32 N6 O4)

Compound Name

2-{1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidin-7-yl}-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}acetamide

IUPAC name

2-{13-dimethyl-24-dioxo-1H2H3H4H7H-pyrrolo[23-d]pyrimidin-7-yl}-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}acetamide

SMILES

CN(c(n(CC(NCCCN(CC1)CCN1c(cccc1)c1OC)=O)cc1)c1C(N1C)=O)C1=O

InChI

InChI=1S/C24H32N6O4/c1-26-22-18(23(32)27(2)24(26)33)9-12-30(22)17-21(31)25-10-6-11-28-13-15-29(16-14-28)19-7-4-5-8-20(19)34-3/h4-5,7-9,12H,6,10-11,13-17H2,1-3H3,(H,25,31)

InChI Key

JSEKKKVTNQWHFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27254368

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.310

Distribution Coefficient, logD

0.901

Water Solubility, LogSw

-2.29

Polar Surface Area

72.569

Acid Dissociation Constant (pKa)

15.67

Base Dissociation Constant (pKb)

7.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.80

References: we are preparing a list of scientific research reports with L462-0468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L462-0468?
Check Price and Availability of L462-0468, 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 L462-0468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L462-0468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L462-0468
  • 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 L462-0468 available by request