7706-1249 Screening compound: methyl 2-amino-6-benzyl-4-(3-chlorophenyl)-7-methyl-5-oxo-4H,5H,6H-pyrano[3,2-c]pyridine-3-carboxylate

7706-1249 Screening compound: methyl 2-amino-6-benzyl-4-(3-chlorophenyl)-7-methyl-5-oxo-4H,5H,6H-pyrano[3,2-c]pyridine-3-carboxylate
7706-1249 Screening compound: methyl 2-amino-6-benzyl-4-(3-chlorophenyl)-7-methyl-5-oxo-4H,5H,6H-pyrano[3,2-c]pyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7706-1249
methyl 2-amino-6-benzyl-4-(3-chlorophenyl)-7-methyl-5-oxo-4H,5H,6H-pyrano[3,2-c]pyridine-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

7706-1249

Molecular Formula

C24H21ClN2O4 (C24 H21 ClN2 O4)

Compound Name

methyl 2-amino-6-benzyl-4-(3-chlorophenyl)-7-methyl-5-oxo-4H,5H,6H-pyrano[3,2-c]pyridine-3-carboxylate

IUPAC name

methyl 2-amino-6-benzyl-4-(3-chlorophenyl)-7-methyl-5-oxo-4H5H6H-pyrano[32-c]pyridine-3-carboxylate

SMILES

CC(N1Cc2ccccc2)=CC(OC(N)=C(C2c3cccc(Cl)c3)C(OC)=O)=C2C1=O

InChI

InChI=1S/C24H21ClN2O4/c1-14-11-18-20(23(28)27(14)13-15-7-4-3-5-8-15)19(16-9-6-10-17(25)12-16)21(22(26)31-18)24(29)30-2/h3-12,19H,13,26H2,1-2H3/t19-/m1/s1

InChI Key

MJDPHXYKKGQWQA-LJQANCHMSA-N

MDL Number (MFCD)

MFCD03687715

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.89

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.053

Distribution Coefficient, logD

4.053

Water Solubility, LogSw

-4.57

Polar Surface Area

65.468

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

-0.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 7706-1249 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7706-1249?
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What is the minimum amount of 7706-1249 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7706-1249
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7706-1249
  • 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 7706-1249 available by request