V017-0007 Screening compound: 2-({allyl[3-(2-furylmethoxy)-2-hydroxypropyl]amino}methyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one

V017-0007 Screening compound: 2-({allyl[3-(2-furylmethoxy)-2-hydroxypropyl]amino}methyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
V017-0007 Screening compound: 2-({allyl[3-(2-furylmethoxy)-2-hydroxypropyl]amino}methyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-0007
2-({allyl[3-(2-furylmethoxy)-2-hydroxypropyl]amino}methyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-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

V017-0007

Molecular Formula

C21H25N3O4S (C21 H25 N3 O4 S)

Compound Name

2-({allyl[3-(2-furylmethoxy)-2-hydroxypropyl]amino}methyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one

IUPAC name

10-[({3-[(furan-2-yl)methoxy]-2-hydroxypropyl}(prop-2-en-1-yl)amino)methyl]-7-thia-911-diazatricyclo[6.4.0.0^{26}]dodeca-1(8)2(6)9-trien-12-one

SMILES

C=CCN(CC(COCc1ccco1)O)CC(N1)=Nc(sc2c3CCC2)c3C1=O

InChI

InChI=1S/C21H25N3O4S/c1-2-8-24(10-14(25)12-27-13-15-5-4-9-28-15)11-18-22-20(26)19-16-6-3-7-17(16)29-21(19)23-18/h2,4-5,9,14,25H,1,3,6-8,10-13H2,(H,22,23,26)/t14-/m0/s1

InChI Key

UFDUZBIVMJOCQE-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD19871279

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

415.51

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

2.459

Distribution Coefficient, logD

2.458

Water Solubility, LogSw

-2.80

Polar Surface Area

71.854

Acid Dissociation Constant (pKa)

10.38

Base Dissociation Constant (pKb)

3.96

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

V017-0007 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V017-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-0007?
Check Price and Availability of V017-0007, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V017-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-0007
  • 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 V017-0007 available by request