F145-0907 Screening compound: 7-(tert-butyl)-2-{3-[4-(3-methylphenyl)piperazino]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

F145-0907 Screening compound: 7-(tert-butyl)-2-{3-[4-(3-methylphenyl)piperazino]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
F145-0907 Screening compound: 7-(tert-butyl)-2-{3-[4-(3-methylphenyl)piperazino]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F145-0907
7-(tert-butyl)-2-{3-[4-(3-methylphenyl)piperazino]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

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

F145-0907

Molecular Formula

C28H36N4O2S (C28 H36 N4 O2 S)

Compound Name

7-(tert-butyl)-2-{3-[4-(3-methylphenyl)piperazino]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

IUPAC name

11-tert-butyl-5-{3-[4-(3-methylphenyl)piperazin-1-yl]-3-oxopropyl}-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)5-trien-3-one

SMILES

CC(C)(C)C(CC1)Cc2c1c(C(NC(CCC(N(CC1)CCN1c1cc(C)ccc1)=O)=N1)=O)c1s2

InChI

InChI=1S/C28H36N4O2S/c1-18-6-5-7-20(16-18)31-12-14-32(15-13-31)24(33)11-10-23-29-26(34)25-21-9-8-19(28(2,3)4)17-22(21)35-27(25)30-23/h5-7,16,19H,8-15,17H2,1-4H3,(H,29,30,34)/t19-/m1/s1

InChI Key

QXEAVKHRGMLTBQ-LJQANCHMSA-N

MDL Number (MFCD)

MFCD14943128

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.69

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.134

Distribution Coefficient, logD

5.133

Water Solubility, LogSw

-5.09

Polar Surface Area

54.376

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

6.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.60

References: we are preparing a list of scientific research reports with F145-0907 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F145-0907?
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What is the minimum amount of F145-0907 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F145-0907
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F145-0907
  • 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 F145-0907 available by request