C201-0277 Screening compound: (2Z)-N-(2,3-dimethylphenyl)-2-(hydroxyimino)-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxamide

C201-0277 Screening compound: (2Z)-N-(2,3-dimethylphenyl)-2-(hydroxyimino)-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxamide
C201-0277 Screening compound: (2Z)-N-(2,3-dimethylphenyl)-2-(hydroxyimino)-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0277
(2Z)-N-(2,3-dimethylphenyl)-2-(hydroxyimino)-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-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

C201-0277

Molecular Formula

C19H20N2O4 (C19 H20 N2 O4)

Compound Name

(2Z)-N-(2,3-dimethylphenyl)-2-(hydroxyimino)-8-methoxy-3,4-dihydro-2H-1-benzopyran-3-carboxamide

IUPAC name

(2Z)-N-(23-dimethylphenyl)-2-(hydroxyimino)-8-methoxy-34-dihydro-2H-1-benzopyran-3-carboxamide

SMILES

Cc1cccc(NC(C(Cc(cccc2OC)c2O2)/C2=N/O)=O)c1C

InChI

InChI=1S/C19H20N2O4/c1-11-6-4-8-15(12(11)2)20-18(22)14-10-13-7-5-9-16(24-3)17(13)25-19(14)21-23/h4-9,14,23H,10H2,1-3H3,(H,20,22)/b21-19-/t14-/m0/s1

InChI Key

GOBFNBWQEAJVTG-MPHHAOFMSA-N

MDL Number (MFCD)

MFCD14729316

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.253

Distribution Coefficient, logD

3.252

Water Solubility, LogSw

-3.32

Polar Surface Area

67.389

Acid Dissociation Constant (pKa)

9.95

Base Dissociation Constant (pKb)

0.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.30

C201-0277 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Dark Chemical Matter Library (18430 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with C201-0277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0277?
Check Price and Availability of C201-0277, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C201-0277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0277
  • 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 C201-0277 available by request