L864-1530 Screening compound: 1-(6-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-methylpiperidine-3-carboxamide

L864-1530 Screening compound: 1-(6-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-methylpiperidine-3-carboxamide
L864-1530 Screening compound: 1-(6-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-methylpiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L864-1530
1-(6-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-methylpiperidine-3-carboxamide

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

L864-1530

Molecular Formula

C21H22N6O5S (C21 H22 N6 O5 S)

Compound Name

1-(6-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-methylpiperidine-3-carboxamide

IUPAC name

1-(6-{[(2H-13-benzodioxol-5-yl)carbamoyl]methyl}-7-oxo-6H7H-[13]thiazolo[45-d]pyrimidin-2-yl)-N-methylpiperidine-3-carboxamide

SMILES

CNC(C(CCC1)CN1c1nc(N=CN(CC(Nc(cc2)cc3c2OCO3)=O)C2=O)c2s1)=O

InChI

InChI=1S/C21H22N6O5S/c1-22-19(29)12-3-2-6-26(8-12)21-25-18-17(33-21)20(30)27(10-23-18)9-16(28)24-13-4-5-14-15(7-13)32-11-31-14/h4-5,7,10,12H,2-3,6,8-9,11H2,1H3,(H,22,29)(H,24,28)/t12-/m0/s1

InChI Key

KVRGWNBLNXFRKZ-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD15135443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.409

Distribution Coefficient, logD

1.409

Water Solubility, LogSw

-2.51

Polar Surface Area

105.221

Acid Dissociation Constant (pKa)

11.61

Base Dissociation Constant (pKb)

0.99

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

L864-1530 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with L864-1530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L864-1530?
Check Price and Availability of L864-1530, 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 L864-1530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L864-1530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L864-1530
  • 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 L864-1530 available by request