L164-0827 Screening compound: N-butyl-1-[4-(3,4-dimethylbenzenesulfonamido)phenyl]cyclopropane-1-carboxamide

L164-0827 Screening compound: N-butyl-1-[4-(3,4-dimethylbenzenesulfonamido)phenyl]cyclopropane-1-carboxamide
L164-0827 Screening compound: N-butyl-1-[4-(3,4-dimethylbenzenesulfonamido)phenyl]cyclopropane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L164-0827
N-butyl-1-[4-(3,4-dimethylbenzenesulfonamido)phenyl]cyclopropane-1-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

L164-0827

Molecular Formula

C22H28N2O3S (C22 H28 N2 O3 S)

Compound Name

N-butyl-1-[4-(3,4-dimethylbenzenesulfonamido)phenyl]cyclopropane-1-carboxamide

IUPAC name

N-butyl-1-[4-(34-dimethylbenzenesulfonamido)phenyl]cyclopropane-1-carboxamide

SMILES

CCCCNC(C1(CC1)c(cc1)ccc1NS(c1cc(C)c(C)cc1)(=O)=O)=O

InChI

InChI=1S/C22H28N2O3S/c1-4-5-14-23-21(25)22(12-13-22)18-7-9-19(10-8-18)24-28(26,27)20-11-6-16(2)17(3)15-20/h6-11,15,24H,4-5,12-14H2,1-3H3,(H,23,25)

InChI Key

PMYYXSPDHKPDIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27235675

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

400.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.631

Distribution Coefficient, logD

4.619

Water Solubility, LogSw

-4.35

Polar Surface Area

65.666

Acid Dissociation Constant (pKa)

8.95

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

L164-0827 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with L164-0827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L164-0827?
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What is the minimum amount of L164-0827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L164-0827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L164-0827
  • 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 L164-0827 available by request