K913-0290 Screening compound: 1-[6-(4-benzylpiperidine-1-carbonyl)-5-methylthieno[2,3-d]pyrimidin-4-yl]-4-phenylpiperazine

K913-0290 Screening compound: 1-[6-(4-benzylpiperidine-1-carbonyl)-5-methylthieno[2,3-d]pyrimidin-4-yl]-4-phenylpiperazine
K913-0290 Screening compound: 1-[6-(4-benzylpiperidine-1-carbonyl)-5-methylthieno[2,3-d]pyrimidin-4-yl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound K913-0290
1-[6-(4-benzylpiperidine-1-carbonyl)-5-methylthieno[2,3-d]pyrimidin-4-yl]-4-phenylpiperazine

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

K913-0290

Molecular Formula

C30H33N5OS (C30 H33 N5 OS)

Compound Name

1-[6-(4-benzylpiperidine-1-carbonyl)-5-methylthieno[2,3-d]pyrimidin-4-yl]-4-phenylpiperazine

IUPAC name

1-[6-(4-benzylpiperidine-1-carbonyl)-5-methylthieno[23-d]pyrimidin-4-yl]-4-phenylpiperazine

SMILES

Cc1c(C(N2CCC(Cc3ccccc3)CC2)=O)sc2ncnc(N(CC3)CCN3c3ccccc3)c12

InChI

InChI=1S/C30H33N5OS/c1-22-26-28(34-18-16-33(17-19-34)25-10-6-3-7-11-25)31-21-32-29(26)37-27(22)30(36)35-14-12-24(13-15-35)20-23-8-4-2-5-9-23/h2-11,21,24H,12-20H2,1H3

InChI Key

SFWDHTNITIERQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15114093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.69

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.563

Distribution Coefficient, logD

6.448

Water Solubility, LogSw

-6.05

Polar Surface Area

44.176

Acid Dissociation Constant (pKa)

22.15

Base Dissociation Constant (pKb)

6.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.70

K913-0290 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K913-0290 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K913-0290?
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What is the minimum amount of K913-0290 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K913-0290
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K913-0290
  • 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 K913-0290 available by request