K805-0484 Screening compound: methyl 4-[7-methoxy-2-(3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate

K805-0484 Screening compound: methyl 4-[7-methoxy-2-(3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate
K805-0484 Screening compound: methyl 4-[7-methoxy-2-(3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound K805-0484
methyl 4-[7-methoxy-2-(3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]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

K805-0484

Molecular Formula

C26H24N2O5 (C26 H24 N2 O5)

Compound Name

methyl 4-[7-methoxy-2-(3-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate

IUPAC name

methyl 4-[10-methoxy-4-(3-methoxyphenyl)-8-oxa-56-diazatricyclo[7.4.0.0^{26}]trideca-1(9)41012-tetraen-7-yl]benzoate

SMILES

COC(c1ccc(C(N(C(C2)c3ccc4)N=C2c2cc(OC)ccc2)Oc3c4OC)cc1)=O

InChI

InChI=1S/C26H24N2O5/c1-30-19-7-4-6-18(14-19)21-15-22-20-8-5-9-23(31-2)24(20)33-25(28(22)27-21)16-10-12-17(13-11-16)26(29)32-3/h4-14,22,25H,15H2,1-3H3

InChI Key

NZBTVZASNQQZPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05719085

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.267

Distribution Coefficient, logD

5.267

Water Solubility, LogSw

-5.37

Polar Surface Area

58.078

Acid Dissociation Constant (pKa)

17.24

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with K805-0484 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K805-0484?
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What is the minimum amount of K805-0484 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K805-0484
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K805-0484
  • 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 K805-0484 available by request