1601-0109 Screening compound: N-[(N'-cyclohexylidenehydrazinecarbonyl)methyl]-4-methylbenzene-1-sulfonamide

1601-0109 Screening compound: N-[(N'-cyclohexylidenehydrazinecarbonyl)methyl]-4-methylbenzene-1-sulfonamide
1601-0109 Screening compound: N-[(N'-cyclohexylidenehydrazinecarbonyl)methyl]-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1601-0109
N-[(N'-cyclohexylidenehydrazinecarbonyl)methyl]-4-methylbenzene-1-sulfonamide

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

1601-0109

Molecular Formula

C15H21N3O3S (C15 H21 N3 O3 S)

Compound Name

N-[(N'-cyclohexylidenehydrazinecarbonyl)methyl]-4-methylbenzene-1-sulfonamide

IUPAC name

N-[(N'-cyclohexylidenehydrazinecarbonyl)methyl]-4-methylbenzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(NCC(NN=C1CCCCC1)=O)(=O)=O

InChI

InChI=1S/C15H21N3O3S/c1-12-7-9-14(10-8-12)22(20,21)16-11-15(19)18-17-13-5-3-2-4-6-13/h7-10,16H,2-6,11H2,1H3,(H,18,19)

InChI Key

GUMKFMBNXYELTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00685964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.172

Distribution Coefficient, logD

2.171

Water Solubility, LogSw

-2.91

Polar Surface Area

77.599

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

1.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

1601-0109 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1601-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1601-0109?
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What is the minimum amount of 1601-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1601-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1601-0109
  • 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 1601-0109 available by request