C759-0352 Screening compound: methyl 2-[2-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl)acetamido]benzoate

C759-0352 Screening compound: methyl 2-[2-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl)acetamido]benzoate
C759-0352 Screening compound: methyl 2-[2-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl)acetamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C759-0352
methyl 2-[2-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl)acetamido]benzoate

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

C759-0352

Molecular Formula

C19H18N2O5 (C19 H18 N2 O5)

Compound Name

methyl 2-[2-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl)acetamido]benzoate

IUPAC name

methyl 2-[2-(6-methyl-3-oxo-34-dihydro-2H-14-benzoxazin-2-yl)acetamido]benzoate

SMILES

Cc(cc1)cc(N2)c1OC(CC(Nc(cccc1)c1C(OC)=O)=O)C2=O

InChI

InChI=1S/C19H18N2O5/c1-11-7-8-15-14(9-11)21-18(23)16(26-15)10-17(22)20-13-6-4-3-5-12(13)19(24)25-2/h3-9,16H,10H2,1-2H3,(H,20,22)(H,21,23)/t16-/m0/s1

InChI Key

PTIQEAMQHYVQKA-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14791823

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.254

Distribution Coefficient, logD

2.158

Water Solubility, LogSw

-3.09

Polar Surface Area

76.395

Acid Dissociation Constant (pKa)

8.01

Base Dissociation Constant (pKb)

-0.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.10

C759-0352 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C759-0352 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C759-0352?
Check Price and Availability of C759-0352, 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 C759-0352 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C759-0352
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C759-0352
  • 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 C759-0352 available by request