V020-6468 Screening compound: 2-({(2-furylmethyl)[2-hydroxy-3-(2-propynyloxy)propyl]amino}methyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

V020-6468 Screening compound: 2-({(2-furylmethyl)[2-hydroxy-3-(2-propynyloxy)propyl]amino}methyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
V020-6468 Screening compound: 2-({(2-furylmethyl)[2-hydroxy-3-(2-propynyloxy)propyl]amino}methyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-6468
2-({(2-furylmethyl)[2-hydroxy-3-(2-propynyloxy)propyl]amino}methyl)-7-methyl-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

V020-6468

Molecular Formula

C23H27N3O4S (C23 H27 N3 O4 S)

Compound Name

2-({(2-furylmethyl)[2-hydroxy-3-(2-propynyloxy)propyl]amino}methyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

IUPAC name

5-({[(furan-2-yl)methyl][2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]amino}methyl)-11-methyl-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)5-trien-3-one

SMILES

CC(CC1)Cc2c1c(C(NC(CN(CC(COCC#C)O)Cc1ccco1)=N1)=O)c1s2

InChI

InChI=1S/C23H27N3O4S/c1-3-8-29-14-16(27)11-26(12-17-5-4-9-30-17)13-20-24-22(28)21-18-7-6-15(2)10-19(18)31-23(21)25-20/h1,4-5,9,15-16,27H,6-8,10-14H2,2H3,(H,24,25,28)

InChI Key

HLJWFNWIJOJTFE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19874000

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

441.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.938

Distribution Coefficient, logD

2.936

Water Solubility, LogSw

-3.46

Polar Surface Area

71.428

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

47.83

References: we are preparing a list of scientific research reports with V020-6468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-6468?
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What is the minimum amount of V020-6468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-6468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-6468
  • 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 V020-6468 available by request