V009-3718 Screening compound: 2-({allyl[3-(allyloxy)-2-hydroxypropyl]amino}methyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one

V009-3718 Screening compound: 2-({allyl[3-(allyloxy)-2-hydroxypropyl]amino}methyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
V009-3718 Screening compound: 2-({allyl[3-(allyloxy)-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 V009-3718
2-({allyl[3-(allyloxy)-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

V009-3718

Molecular Formula

C19H25N3O3S (C19 H25 N3 O3 S)

Compound Name

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

IUPAC name

10-({[2-hydroxy-3-(prop-2-en-1-yloxy)propyl](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(COCC=C)O)CC(N1)=Nc(sc2c3CCC2)c3C1=O

InChI

InChI=1S/C19H25N3O3S/c1-3-8-22(10-13(23)12-25-9-4-2)11-16-20-18(24)17-14-6-5-7-15(14)26-19(17)21-16/h3-4,13,23H,1-2,5-12H2,(H,20,21,24)/t13-/m0/s1

InChI Key

YHZAQPYTSCJKAM-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD19871280

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

375.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.989

Distribution Coefficient, logD

1.988

Water Solubility, LogSw

-2.48

Polar Surface Area

64.295

Acid Dissociation Constant (pKa)

10.38

Base Dissociation Constant (pKb)

3.96

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.37

V009-3718 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V009-3718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-3718?
Check Price and Availability of V009-3718, 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 V009-3718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-3718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-3718
  • 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 V009-3718 available by request