8009-1157 Screening compound: 1-{2-[(E)-(2-{2-[bis(2-methylpropyl)sulfamoyl]-4-nitrophenyl}hydrazin-1-ylidene)methyl]phenyl}-N,N-diethylpiperidine-3-carboxamide

8009-1157 Screening compound: 1-{2-[(E)-(2-{2-[bis(2-methylpropyl)sulfamoyl]-4-nitrophenyl}hydrazin-1-ylidene)methyl]phenyl}-N,N-diethylpiperidine-3-carboxamide
8009-1157 Screening compound: 1-{2-[(E)-(2-{2-[bis(2-methylpropyl)sulfamoyl]-4-nitrophenyl}hydrazin-1-ylidene)methyl]phenyl}-N,N-diethylpiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-1157
1-{2-[(E)-(2-{2-[bis(2-methylpropyl)sulfamoyl]-4-nitrophenyl}hydrazin-1-ylidene)methyl]phenyl}-N,N-diethylpiperidine-3-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

8009-1157

Molecular Formula

C31H46N6O5S (C31 H46 N6 O5 S)

Compound Name

1-{2-[(E)-(2-{2-[bis(2-methylpropyl)sulfamoyl]-4-nitrophenyl}hydrazin-1-ylidene)methyl]phenyl}-N,N-diethylpiperidine-3-carboxamide

IUPAC name

1-{2-[(E)-(2-{2-[bis(2-methylpropyl)sulfamoyl]-4-nitrophenyl}hydrazin-1-ylidene)methyl]phenyl}-NN-diethylpiperidine-3-carboxamide

SMILES

CCN(CC)C(C(CCC1)CN1c1c(/C=N/Nc(ccc([N+]([O-])=O)c2)c2S(N(CC(C)C)CC(C)C)(=O)=O)cccc1)=O

InChI

InChI=1S/C31H46N6O5S/c1-7-34(8-2)31(38)26-13-11-17-35(22-26)29-14-10-9-12-25(29)19-32-33-28-16-15-27(37(39)40)18-30(28)43(41,42)36(20-23(3)4)21-24(5)6/h9-10,12,14-16,18-19,23-24,26,33H,7-8,11,13,17,20-22H2,1-6H3/t26-/m0/s1

InChI Key

GIKUBILGXYMSLL-SANMLTNESA-N

MDL Number (MFCD)

MFCD01461325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

614.81

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

6.368

Distribution Coefficient, logD

6.367

Water Solubility, LogSw

-5.46

Polar Surface Area

104.723

Acid Dissociation Constant (pKa)

13.13

Base Dissociation Constant (pKb)

4.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.80

References: we are preparing a list of scientific research reports with 8009-1157 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-1157?
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What is the minimum amount of 8009-1157 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-1157
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-1157
  • 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 8009-1157 available by request