8016-3710 Screening compound: methyl 5-amino-6-cyano-7-(2,3-dimethoxyphenyl)-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate

8016-3710 Screening compound: methyl 5-amino-6-cyano-7-(2,3-dimethoxyphenyl)-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate
8016-3710 Screening compound: methyl 5-amino-6-cyano-7-(2,3-dimethoxyphenyl)-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-3710
methyl 5-amino-6-cyano-7-(2,3-dimethoxyphenyl)-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate

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

8016-3710

Molecular Formula

C19H18N2O5S (C19 H18 N2 O5 S)

Compound Name

methyl 5-amino-6-cyano-7-(2,3-dimethoxyphenyl)-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate

IUPAC name

methyl 5-amino-6-cyano-7-(23-dimethoxyphenyl)-2-methyl-7H-thieno[32-b]pyran-3-carboxylate

SMILES

Cc1c(C(OC)=O)c(OC(N)=C(C2c(cccc3OC)c3OC)C#N)c2s1

InChI

InChI=1S/C19H18N2O5S/c1-9-13(19(22)25-4)16-17(27-9)14(11(8-20)18(21)26-16)10-6-5-7-12(23-2)15(10)24-3/h5-7,14H,21H2,1-4H3/t14-/m0/s1

InChI Key

ZTWWINIXDYZVOA-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD05855831

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.901

Distribution Coefficient, logD

2.901

Water Solubility, LogSw

-3.36

Polar Surface Area

83.518

Acid Dissociation Constant (pKa)

15.91

Base Dissociation Constant (pKb)

-0.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with 8016-3710 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-3710?
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What is the minimum amount of 8016-3710 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-3710
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-3710
  • 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 8016-3710 available by request