L387-4844 Screening compound: 2-{[6-methyl-7-oxo-2-(pyrrolidin-1-yl)-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide

L387-4844 Screening compound: 2-{[6-methyl-7-oxo-2-(pyrrolidin-1-yl)-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
L387-4844 Screening compound: 2-{[6-methyl-7-oxo-2-(pyrrolidin-1-yl)-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L387-4844
2-{[6-methyl-7-oxo-2-(pyrrolidin-1-yl)-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)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

L387-4844

Molecular Formula

C21H25N5O5S2 (C21 H25 N5 O5 S2)

Compound Name

2-{[6-methyl-7-oxo-2-(pyrrolidin-1-yl)-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide

IUPAC name

2-{[6-methyl-7-oxo-2-(pyrrolidin-1-yl)-6H7H-[13]thiazolo[45-d]pyrimidin-5-yl]sulfanyl}-N-(345-trimethoxyphenyl)acetamide

SMILES

CN(C1=O)C(SCC(Nc(cc2OC)cc(OC)c2OC)=O)=Nc2c1sc(N1CCCC1)n2

InChI

InChI=1S/C21H25N5O5S2/c1-25-19(28)17-18(24-21(33-17)26-7-5-6-8-26)23-20(25)32-11-15(27)22-12-9-13(29-2)16(31-4)14(10-12)30-3/h9-10H,5-8,11H2,1-4H3,(H,22,27)

InChI Key

LWRDEFWBOZYYCR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27249950

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.59

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.656

Distribution Coefficient, logD

2.656

Water Solubility, LogSw

-3.10

Polar Surface Area

86.150

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with L387-4844 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L387-4844?
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What is the minimum amount of L387-4844 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L387-4844
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L387-4844
  • 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 L387-4844 available by request