H025-3158C Screening compound: 4-benzyl-2,7-dimethyl-5,6,7,8-tetrahydro-4H-thieno[2',3':4,5]pyrrolo[3,2-c]pyridine

H025-3158C Screening compound: 4-benzyl-2,7-dimethyl-5,6,7,8-tetrahydro-4H-thieno[2',3':4,5]pyrrolo[3,2-c]pyridine
H025-3158C Screening compound: 4-benzyl-2,7-dimethyl-5,6,7,8-tetrahydro-4H-thieno[2',3':4,5]pyrrolo[3,2-c]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound H025-3158C
4-benzyl-2,7-dimethyl-5,6,7,8-tetrahydro-4H-thieno[2',3':4,5]pyrrolo[3,2-c]pyridine

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

H025-3158C

Molecular Formula

C18H20N2S (C18 H20 N2 S)

Compound Name

4-benzyl-2,7-dimethyl-5,6,7,8-tetrahydro-4H-thieno[2',3':4,5]pyrrolo[3,2-c]pyridine

IUPAC name

7-benzyl-411-dimethyl-3-thia-711-diazatricyclo[6.4.0.0^{26}]dodeca-1(8)2(6)4-triene

SMILES

Cc1cc(n(Cc2ccccc2)c2c3CN(C)CC2)c3s1

InChI

InChI=1S/C18H20N2S/c1-13-10-17-18(21-13)15-12-19(2)9-8-16(15)20(17)11-14-6-4-3-5-7-14/h3-7,10H,8-9,11-12H2,1-2H3

InChI Key

AQLQGWLUZMUWPJ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

296.44

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.032

Distribution Coefficient, logD

0.148

Water Solubility, LogSw

-4.19

Polar Surface Area

5.773

Acid Dissociation Constant (pKa)

27.75

Base Dissociation Constant (pKb)

11.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

References: we are preparing a list of scientific research reports with H025-3158C chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H025-3158C?
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What is the minimum amount of H025-3158C you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H025-3158C
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H025-3158C
  • 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 H025-3158C available by request