C382-0406 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(4-acetamidobenzenesulfonamido)methyl]benzamide

C382-0406 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(4-acetamidobenzenesulfonamido)methyl]benzamide
C382-0406 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(4-acetamidobenzenesulfonamido)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C382-0406
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(4-acetamidobenzenesulfonamido)methyl]benzamide

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

C382-0406

Molecular Formula

C24H29N3O4S (C24 H29 N3 O4 S)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(4-acetamidobenzenesulfonamido)methyl]benzamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(4-acetamidobenzenesulfonamido)methyl]benzamide

SMILES

CC(Nc(cc1)ccc1S(NCc(cc1)ccc1C(NCCC1=CCCCC1)=O)(=O)=O)=O

InChI

InChI=1S/C24H29N3O4S/c1-18(28)27-22-11-13-23(14-12-22)32(30,31)26-17-20-7-9-21(10-8-20)24(29)25-16-15-19-5-3-2-4-6-19/h5,7-14,26H,2-4,6,15-17H2,1H3,(H,25,29)(H,27,28)

InChI Key

SPEWZSVEIXYOGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14754980

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.896

Distribution Coefficient, logD

2.896

Water Solubility, LogSw

-3.54

Polar Surface Area

89.706

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

-1.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with C382-0406 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C382-0406?
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What is the minimum amount of C382-0406 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C382-0406
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C382-0406
  • 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 C382-0406 available by request