L864-1759 Screening compound: 1-(6-{[(4-butylphenyl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-ethylpiperidine-3-carboxamide

L864-1759 Screening compound: 1-(6-{[(4-butylphenyl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-ethylpiperidine-3-carboxamide
L864-1759 Screening compound: 1-(6-{[(4-butylphenyl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-ethylpiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L864-1759
1-(6-{[(4-butylphenyl)carbamoyl]methyl}-7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)-N-ethylpiperidine-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

L864-1759

Molecular Formula

C25H32N6O3S (C25 H32 N6 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCCCc(cc1)ccc1NC(CN(C=Nc1c2sc(N(CCC3)CC3C(NCC)=O)n1)C2=O)=O

InChI

InChI=1S/C25H32N6O3S/c1-3-5-7-17-9-11-19(12-10-17)28-20(32)15-31-16-27-22-21(24(31)34)35-25(29-22)30-13-6-8-18(14-30)23(33)26-4-2/h9-12,16,18H,3-8,13-15H2,1-2H3,(H,26,33)(H,28,32)/t18-/m0/s1

InChI Key

ITUZTQCZFMUISV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15135536

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.994

Distribution Coefficient, logD

3.994

Water Solubility, LogSw

-3.92

Polar Surface Area

87.581

Acid Dissociation Constant (pKa)

12.79

Base Dissociation Constant (pKb)

0.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

L864-1759 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Regenerative Medicine Focused Library (23016 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with L864-1759 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L864-1759?
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What is the minimum amount of L864-1759 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L864-1759
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L864-1759
  • 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 L864-1759 available by request