D136-0062 Screening compound: N-(2-methoxyphenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide

D136-0062 Screening compound: N-(2-methoxyphenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
D136-0062 Screening compound: N-(2-methoxyphenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D136-0062
N-(2-methoxyphenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide

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

D136-0062

Molecular Formula

C23H19NO4 (C23 H19 NO4)

Compound Name

N-(2-methoxyphenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide

IUPAC name

N-(2-methoxyphenyl)-1-oxo-3-phenyl-34-dihydro-1H-2-benzopyran-6-carboxamide

SMILES

COc(cccc1)c1NC(c(cc1)cc(CC(c2ccccc2)O2)c1C2=O)=O

InChI

InChI=1S/C23H19NO4/c1-27-20-10-6-5-9-19(20)24-22(25)16-11-12-18-17(13-16)14-21(28-23(18)26)15-7-3-2-4-8-15/h2-13,21H,14H2,1H3,(H,24,25)/t21-/m0/s1

InChI Key

CSBDJZTWWAOHBK-NRFANRHFSA-N

MDL Number (MFCD)

MFCD06438573

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.527

Distribution Coefficient, logD

4.518

Water Solubility, LogSw

-4.44

Polar Surface Area

50.815

Acid Dissociation Constant (pKa)

9.09

Base Dissociation Constant (pKb)

-1.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with D136-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D136-0062?
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What is the minimum amount of D136-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D136-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D136-0062
  • 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 D136-0062 available by request