T636-2416 Screening compound: 1-[3-({5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}amino)pyrrolidin-1-yl]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one

T636-2416 Screening compound: 1-[3-({5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}amino)pyrrolidin-1-yl]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one
T636-2416 Screening compound: 1-[3-({5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}amino)pyrrolidin-1-yl]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T636-2416
1-[3-({5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}amino)pyrrolidin-1-yl]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-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

T636-2416

Molecular Formula

C19H26N6O (C19 H26 N6 O)

Compound Name

1-[3-({5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}amino)pyrrolidin-1-yl]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one

IUPAC name

1-[3-({5H6H7H-cyclopenta[d]pyrimidin-4-yl}amino)pyrrolidin-1-yl]-3-(35-dimethyl-1H-pyrazol-1-yl)propan-1-one

SMILES

Cc1cc(C)nn1CCC(N(CC1)CC1Nc1ncnc2c1CCC2)=O

InChI

InChI=1S/C19H26N6O/c1-13-10-14(2)25(23-13)9-7-18(26)24-8-6-15(11-24)22-19-16-4-3-5-17(16)20-12-21-19/h10,12,15H,3-9,11H2,1-2H3,(H,20,21,22)/t15-/m1/s1

InChI Key

XEQUMUJHTGITBU-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD27623047

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.908

Distribution Coefficient, logD

0.903

Water Solubility, LogSw

-1.89

Polar Surface Area

62.649

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

5.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.90

T636-2416 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with T636-2416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T636-2416?
Check Price and Availability of T636-2416, 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 T636-2416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T636-2416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T636-2416
  • 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 T636-2416 available by request