L865-1971 Screening compound: 1-(6-{[(3-acetylphenyl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-(propan-2-yl)piperidine-4-carboxamide

L865-1971 Screening compound: 1-(6-{[(3-acetylphenyl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-(propan-2-yl)piperidine-4-carboxamide
L865-1971 Screening compound: 1-(6-{[(3-acetylphenyl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-(propan-2-yl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L865-1971
1-(6-{[(3-acetylphenyl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-(propan-2-yl)piperidine-4-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

L865-1971

Molecular Formula

C24H28N6O4S (C24 H28 N6 O4 S)

Compound Name

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

IUPAC name

1-(6-{[(3-acetylphenyl)carbamoyl]methyl}-7-oxo-6H7H-[13]thiazolo[45-d]pyrimidin-2-yl)-N-(propan-2-yl)piperidine-4-carboxamide

SMILES

CC(C)NC(C(CC1)CCN1c1nc(N=CN(CC(Nc2cc(C(C)=O)ccc2)=O)C2=O)c2s1)=O

InChI

InChI=1S/C24H28N6O4S/c1-14(2)26-22(33)16-7-9-29(10-8-16)24-28-21-20(35-24)23(34)30(13-25-21)12-19(32)27-18-6-4-5-17(11-18)15(3)31/h4-6,11,13-14,16H,7-10,12H2,1-3H3,(H,26,33)(H,27,32)

InChI Key

TXACPYJZJQVCPK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27482673

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.59

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.137

Distribution Coefficient, logD

2.137

Water Solubility, LogSw

-2.90

Polar Surface Area

100.823

Acid Dissociation Constant (pKa)

11.19

Base Dissociation Constant (pKb)

5.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with L865-1971 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L865-1971
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L865-1971
  • 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 L865-1971 available by request