L027-0377 Screening compound: N-butyl-1-(3-{[(2,4,5-trimethylphenyl)sulfonyl]amino}benzoyl)-2-pyrrolidinecarboxamide

L027-0377 Screening compound: N-butyl-1-(3-{[(2,4,5-trimethylphenyl)sulfonyl]amino}benzoyl)-2-pyrrolidinecarboxamide
L027-0377 Screening compound: N-butyl-1-(3-{[(2,4,5-trimethylphenyl)sulfonyl]amino}benzoyl)-2-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L027-0377
N-butyl-1-(3-{[(2,4,5-trimethylphenyl)sulfonyl]amino}benzoyl)-2-pyrrolidinecarboxamide

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

L027-0377

Molecular Formula

C25H33N3O4S (C25 H33 N3 O4 S)

Compound Name

N-butyl-1-(3-{[(2,4,5-trimethylphenyl)sulfonyl]amino}benzoyl)-2-pyrrolidinecarboxamide

IUPAC name

N-butyl-1-[3-(245-trimethylbenzenesulfonamido)benzoyl]pyrrolidine-2-carboxamide

SMILES

CCCCNC(C(CCC1)N1C(c1cccc(NS(c2c(C)cc(C)c(C)c2)(=O)=O)c1)=O)=O

InChI

InChI=1S/C25H33N3O4S/c1-5-6-12-26-24(29)22-11-8-13-28(22)25(30)20-9-7-10-21(16-20)27-33(31,32)23-15-18(3)17(2)14-19(23)4/h7,9-10,14-16,22,27H,5-6,8,11-13H2,1-4H3,(H,26,29)/t22-/m0/s1

InChI Key

HNJMRWJFKPILSQ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD27226484

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.567

Distribution Coefficient, logD

4.530

Water Solubility, LogSw

-4.28

Polar Surface Area

82.123

Acid Dissociation Constant (pKa)

8.45

Base Dissociation Constant (pKb)

0.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.00

L027-0377 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with L027-0377 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L027-0377?
Check Price and Availability of L027-0377, 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 L027-0377 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L027-0377
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L027-0377
  • 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 L027-0377 available by request