L555-0481 Screening compound: N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide

L555-0481 Screening compound: N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide
L555-0481 Screening compound: N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L555-0481
N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide

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

L555-0481

Molecular Formula

C27H28ClN5O (C27 H28 ClN5 O)

Compound Name

N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide

IUPAC name

N-[(4-chlorophenyl)methyl]-56-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[23-d]pyrimidine-2-carboxamide

SMILES

Cc(c1c(N2CCCCC2)nc(C(NCc(cc2)ccc2Cl)=O)nc11)c(C)n1-c1ccccc1

InChI

InChI=1S/C27H28ClN5O/c1-18-19(2)33(22-9-5-3-6-10-22)26-23(18)25(32-15-7-4-8-16-32)30-24(31-26)27(34)29-17-20-11-13-21(28)14-12-20/h3,5-6,9-14H,4,7-8,15-17H2,1-2H3,(H,29,34)

InChI Key

UBBBSOXNRXKJFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27461603

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.01

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.020

Distribution Coefficient, logD

6.020

Water Solubility, LogSw

-6.06

Polar Surface Area

49.411

Acid Dissociation Constant (pKa)

12.95

Base Dissociation Constant (pKb)

3.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

L555-0481 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L555-0481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L555-0481?
Check Price and Availability of L555-0481, 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 L555-0481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L555-0481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L555-0481
  • 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 L555-0481 available by request