8019-5953 Screening compound: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(hydrazinecarbonyl)formamide

8019-5953 Screening compound: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(hydrazinecarbonyl)formamide
8019-5953 Screening compound: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(hydrazinecarbonyl)formamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-5953
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(hydrazinecarbonyl)formamide

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

8019-5953

Molecular Formula

C12H14N4O2S (C12 H14 N4 O2 S)

Compound Name

N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(hydrazinecarbonyl)formamide

IUPAC name

N-(3-cyano-6-methyl-4567-tetrahydro-1-benzothiophen-2-yl)-1-(hydrazinecarbonyl)formamide

SMILES

CC(CC1)Cc2c1c(C#N)c(NC(C(NN)=O)=O)s2

InChI

InChI=1S/C12H14N4O2S/c1-6-2-3-7-8(5-13)12(19-9(7)4-6)15-10(17)11(18)16-14/h6H,2-4,14H2,1H3,(H,15,17)(H,16,18)/t6-/m1/s1

InChI Key

BSKTXRFTVOKJQQ-ZCFIWIBFSA-N

MDL Number (MFCD)

MFCD10038429

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

278.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.829

Distribution Coefficient, logD

-4.449

Water Solubility, LogSw

-1.98

Polar Surface Area

89.278

Acid Dissociation Constant (pKa)

2.12

Base Dissociation Constant (pKb)

3.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with 8019-5953 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-5953?
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What is the minimum amount of 8019-5953 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-5953
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-5953
  • 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 8019-5953 available by request