5921-0211 Screening compound: N-[5-(2-furyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N-isopentylamine

5921-0211 Screening compound: N-[5-(2-furyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N-isopentylamine
5921-0211 Screening compound: N-[5-(2-furyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N-isopentylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5921-0211
N-[5-(2-furyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N-isopentylamine

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

5921-0211

Molecular Formula

C22H24N4OS (C22 H24 N4 OS)

Compound Name

N-[5-(2-furyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]-N-isopentylamine

IUPAC name

8-(furan-2-yl)-N-(3-methylbutyl)-11-thia-91416-triazatetracyclo[8.7.0.0^{27}.0^{1217}]heptadeca-1(10)2(7)812(17)1315-hexaen-13-amine

SMILES

CC(C)CCNc1c2sc3nc(-c4ccco4)c(CCCC4)c4c3c2ncn1

InChI

InChI=1S/C22H24N4OS/c1-13(2)9-10-23-21-20-19(24-12-25-21)17-14-6-3-4-7-15(14)18(26-22(17)28-20)16-8-5-11-27-16/h5,8,11-13H,3-4,6-7,9-10H2,1-2H3,(H,23,24,25)

InChI Key

SCOGYCDAOXFBMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01960325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.236

Distribution Coefficient, logD

6.235

Water Solubility, LogSw

-5.88

Polar Surface Area

50.239

Acid Dissociation Constant (pKa)

17.89

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

5921-0211 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

C-Met Library (15277 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Nervous system
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 5921-0211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5921-0211?
Check Price and Availability of 5921-0211, 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 5921-0211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5921-0211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5921-0211
  • 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 5921-0211 available by request