8017-9900 Screening compound: N~1~-[2-({2-[(E)-1-cyclohexylmethylidene]hydrazino}carbonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-yl]-2-methoxybenzamide

8017-9900 Screening compound: N~1~-[2-({2-[(E)-1-cyclohexylmethylidene]hydrazino}carbonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-yl]-2-methoxybenzamide
8017-9900 Screening compound: N~1~-[2-({2-[(E)-1-cyclohexylmethylidene]hydrazino}carbonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-yl]-2-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9900
N~1~-[2-({2-[(E)-1-cyclohexylmethylidene]hydrazino}carbonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-yl]-2-methoxybenzamide

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

8017-9900

Molecular Formula

C25H28N4O3S (C25 H28 N4 O3 S)

Compound Name

N~1~-[2-({2-[(E)-1-cyclohexylmethylidene]hydrazino}carbonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-yl]-2-methoxybenzamide

IUPAC name

N-(2-{N'-[(E)-cyclohexylmethylidene]hydrazinecarbonyl}-46-dimethylthieno[23-b]pyridin-3-yl)-2-methoxybenzamide

SMILES

Cc1c(c(NC(c(cccc2)c2OC)=O)c(C(N/N=C/C2CCCCC2)=O)s2)c2nc(C)c1

InChI

InChI=1S/C25H28N4O3S/c1-15-13-16(2)27-25-20(15)21(28-23(30)18-11-7-8-12-19(18)32-3)22(33-25)24(31)29-26-14-17-9-5-4-6-10-17/h7-8,11-14,17H,4-6,9-10H2,1-3H3,(H,28,30)(H,29,31)

InChI Key

UOYLVFDTVCYGEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07021706

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.133

Distribution Coefficient, logD

3.449

Water Solubility, LogSw

-4.45

Polar Surface Area

74.599

Acid Dissociation Constant (pKa)

6.82

Base Dissociation Constant (pKb)

2.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with 8017-9900 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9900?
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What is the minimum amount of 8017-9900 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9900
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9900
  • 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 8017-9900 available by request