3909-8710 Screening compound: methyl 2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-amido}benzoate

3909-8710 Screening compound: methyl 2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-amido}benzoate
3909-8710 Screening compound: methyl 2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3909-8710
methyl 2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-amido}benzoate

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

3909-8710

Molecular Formula

C27H27N5O4S (C27 H27 N5 O4 S)

Compound Name

methyl 2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-amido}benzoate

IUPAC name

methyl 2-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-5-methylthieno[23-d]pyrimidine-6-amido}benzoate

SMILES

Cc1c(C(Nc(cccc2)c2C(OC)=O)=O)sc2ncnc(N(CC3)CCN3c(cc3)ccc3OC)c12

InChI

InChI=1S/C27H27N5O4S/c1-17-22-24(32-14-12-31(13-15-32)18-8-10-19(35-2)11-9-18)28-16-29-26(22)37-23(17)25(33)30-21-7-5-4-6-20(21)27(34)36-3/h4-11,16H,12-15H2,1-3H3,(H,30,33)

InChI Key

QOLSXBIBPOTZFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14709060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

517.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.235

Distribution Coefficient, logD

4.508

Water Solubility, LogSw

-5.19

Polar Surface Area

78.910

Acid Dissociation Constant (pKa)

6.76

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with 3909-8710 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3909-8710?
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What is the minimum amount of 3909-8710 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3909-8710
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3909-8710
  • 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 3909-8710 available by request