L862-0102 Screening compound: 2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]-N-(3-methylphenyl)acetamide

L862-0102 Screening compound: 2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]-N-(3-methylphenyl)acetamide
L862-0102 Screening compound: 2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]-N-(3-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L862-0102
2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]-N-(3-methylphenyl)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

L862-0102

Molecular Formula

C20H23N5O3S (C20 H23 N5 O3 S)

Compound Name

2-[6-ethyl-5,7-dioxo-2-(pyrrolidin-1-yl)-4H,5H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-4-yl]-N-(3-methylphenyl)acetamide

IUPAC name

2-[6-ethyl-57-dioxo-2-(pyrrolidin-1-yl)-4H5H6H7H-[13]thiazolo[45-d]pyrimidin-4-yl]-N-(3-methylphenyl)acetamide

SMILES

CCN(C(c1c(N2CC(Nc3cc(C)ccc3)=O)nc(N3CCCC3)s1)=O)C2=O

InChI

InChI=1S/C20H23N5O3S/c1-3-24-18(27)16-17(22-19(29-16)23-9-4-5-10-23)25(20(24)28)12-15(26)21-14-8-6-7-13(2)11-14/h6-8,11H,3-5,9-10,12H2,1-2H3,(H,21,26)

InChI Key

RLZNWZWJRCIPAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15135271

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.882

Distribution Coefficient, logD

3.882

Water Solubility, LogSw

-3.74

Polar Surface Area

69.334

Acid Dissociation Constant (pKa)

13.08

Base Dissociation Constant (pKb)

1.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with L862-0102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L862-0102?
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What is the minimum amount of L862-0102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L862-0102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L862-0102
  • 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 L862-0102 available by request