L681-0193 Screening compound: N-(2,5-dimethylphenyl)-2-{2-ethyl-6-[(4-methylphenyl)methyl]-5,7-dioxo-2H,4H,5H,6H,7H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide

L681-0193 Screening compound: N-(2,5-dimethylphenyl)-2-{2-ethyl-6-[(4-methylphenyl)methyl]-5,7-dioxo-2H,4H,5H,6H,7H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide
L681-0193 Screening compound: N-(2,5-dimethylphenyl)-2-{2-ethyl-6-[(4-methylphenyl)methyl]-5,7-dioxo-2H,4H,5H,6H,7H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L681-0193
N-(2,5-dimethylphenyl)-2-{2-ethyl-6-[(4-methylphenyl)methyl]-5,7-dioxo-2H,4H,5H,6H,7H-pyrazolo[4,3-d]pyrimidin-4-yl}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

L681-0193

Molecular Formula

C25H27N5O3 (C25 H27 N5 O3)

Compound Name

N-(2,5-dimethylphenyl)-2-{2-ethyl-6-[(4-methylphenyl)methyl]-5,7-dioxo-2H,4H,5H,6H,7H-pyrazolo[4,3-d]pyrimidin-4-yl}acetamide

IUPAC name

N-(25-dimethylphenyl)-2-{2-ethyl-6-[(4-methylphenyl)methyl]-57-dioxo-2H4H5H6H7H-pyrazolo[43-d]pyrimidin-4-yl}acetamide

SMILES

CCn(cc1N(CC(Nc2c(C)ccc(C)c2)=O)C(N2Cc3ccc(C)cc3)=O)nc1C2=O

InChI

InChI=1S/C25H27N5O3/c1-5-28-14-21-23(27-28)24(32)30(13-19-10-7-16(2)8-11-19)25(33)29(21)15-22(31)26-20-12-17(3)6-9-18(20)4/h6-12,14H,5,13,15H2,1-4H3,(H,26,31)

InChI Key

FUEVNMGQAKVWFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27469439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.251

Distribution Coefficient, logD

3.251

Water Solubility, LogSw

-3.15

Polar Surface Area

68.858

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with L681-0193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L681-0193?
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What is the minimum amount of L681-0193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L681-0193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L681-0193
  • 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 L681-0193 available by request