T636-0232 Screening compound: 4-[3,4-dihydro-2(1H)-isoquinolinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine

T636-0232 Screening compound: 4-[3,4-dihydro-2(1H)-isoquinolinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
T636-0232 Screening compound: 4-[3,4-dihydro-2(1H)-isoquinolinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound T636-0232
4-[3,4-dihydro-2(1H)-isoquinolinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine

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

T636-0232

Molecular Formula

C16H17N3 (C16 H17 N3)

Compound Name

4-[3,4-dihydro-2(1H)-isoquinolinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine

IUPAC name

n/a

SMILES

C(C1)Cc2c1c(N(CC1)Cc3c1cccc3)ncn2

InChI

InChI=1S/C16H17N3/c1-2-5-13-10-19(9-8-12(13)4-1)16-14-6-3-7-15(14)17-11-18-16/h1-2,4-5,11H,3,6-10H2

InChI Key

KFVQELZQMDHQFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27622865

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

251.33

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.384

Distribution Coefficient, logD

3.212

Water Solubility, LogSw

-3.39

Polar Surface Area

24.883

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

7.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

T636-0232 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Agro:
  • Agro
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with T636-0232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T636-0232?
Check Price and Availability of T636-0232, 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 T636-0232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T636-0232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T636-0232
  • 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 T636-0232 available by request