T636-1114 Screening compound: N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)tetrahydro-1H-pyrrol-3-yl]-3-methyl-2-thiophenecarboxamide

T636-1114 Screening compound: N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)tetrahydro-1H-pyrrol-3-yl]-3-methyl-2-thiophenecarboxamide
T636-1114 Screening compound: N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)tetrahydro-1H-pyrrol-3-yl]-3-methyl-2-thiophenecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T636-1114
N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)tetrahydro-1H-pyrrol-3-yl]-3-methyl-2-thiophenecarboxamide

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

T636-1114

Molecular Formula

C17H20N4OS (C17 H20 N4 OS)

Compound Name

N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)tetrahydro-1H-pyrrol-3-yl]-3-methyl-2-thiophenecarboxamide

IUPAC name

n/a

SMILES

Cc1c(C(NC(CC2)CN2c2ncnc3c2CCC3)=O)scc1

InChI

InChI=1S/C17H20N4OS/c1-11-6-8-23-15(11)17(22)20-12-5-7-21(9-12)16-13-3-2-4-14(13)18-10-19-16/h6,8,10,12H,2-5,7,9H2,1H3,(H,20,22)/t12-/m0/s1

InChI Key

OTQNNKKTXDIOQN-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD27622915

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.935

Distribution Coefficient, logD

2.915

Water Solubility, LogSw

-3.35

Polar Surface Area

50.485

Acid Dissociation Constant (pKa)

14.24

Base Dissociation Constant (pKb)

6.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.06

T636-1114 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T636-1114 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T636-1114?
Check Price and Availability of T636-1114, 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 T636-1114 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T636-1114
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T636-1114
  • 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 T636-1114 available by request