K850-0277 Screening compound: ethyl 1-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylate

K850-0277 Screening compound: ethyl 1-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylate
K850-0277 Screening compound: ethyl 1-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K850-0277
ethyl 1-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylate

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

K850-0277

Molecular Formula

C25H28N4O6S (C25 H28 N4 O6 S)

Compound Name

ethyl 1-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-(3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-3H4H-thieno[23-d]pyrimidine-6-carbonyl)piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c1c(C)c(C(N(CC(Nc(cccc2)c2OC)=O)C=N2)=O)c2s1)=O)=O

InChI

InChI=1S/C25H28N4O6S/c1-4-35-25(33)16-9-11-28(12-10-16)24(32)21-15(2)20-22(36-21)26-14-29(23(20)31)13-19(30)27-17-7-5-6-8-18(17)34-3/h5-8,14,16H,4,9-13H2,1-3H3,(H,27,30)

InChI Key

NIURRQKYZKWBIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15110833

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.59

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.252

Distribution Coefficient, logD

2.252

Water Solubility, LogSw

-2.71

Polar Surface Area

93.725

Acid Dissociation Constant (pKa)

11.49

Base Dissociation Constant (pKb)

0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with K850-0277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K850-0277?
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What is the minimum amount of K850-0277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K850-0277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K850-0277
  • 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 K850-0277 available by request