M277-1457 Screening compound: 7-fluoro-3-[1-(3-phenylpropanoyl)piperidin-4-yl]-3,4-dihydro-1,2,3-benzotriazin-4-one

M277-1457 Screening compound: 7-fluoro-3-[1-(3-phenylpropanoyl)piperidin-4-yl]-3,4-dihydro-1,2,3-benzotriazin-4-one
M277-1457 Screening compound: 7-fluoro-3-[1-(3-phenylpropanoyl)piperidin-4-yl]-3,4-dihydro-1,2,3-benzotriazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M277-1457
7-fluoro-3-[1-(3-phenylpropanoyl)piperidin-4-yl]-3,4-dihydro-1,2,3-benzotriazin-4-one

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

M277-1457

Molecular Formula

C21H21FN4O2 (C21 H21 FN4 O2)

Compound Name

7-fluoro-3-[1-(3-phenylpropanoyl)piperidin-4-yl]-3,4-dihydro-1,2,3-benzotriazin-4-one

IUPAC name

7-fluoro-3-[1-(3-phenylpropanoyl)piperidin-4-yl]-34-dihydro-123-benzotriazin-4-one

SMILES

O=C(CCc1ccccc1)N(CC1)CCC1N1N=Nc(cc(cc2)F)c2C1=O

InChI

InChI=1S/C21H21FN4O2/c22-16-7-8-18-19(14-16)23-24-26(21(18)28)17-10-12-25(13-11-17)20(27)9-6-15-4-2-1-3-5-15/h1-5,7-8,14,17H,6,9-13H2

InChI Key

LFXINMLCGGCMRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15141531

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.903

Distribution Coefficient, logD

3.903

Water Solubility, LogSw

-4.08

Polar Surface Area

55.275

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

M277-1457 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with M277-1457 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M277-1457?
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What is the minimum amount of M277-1457 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M277-1457
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M277-1457
  • 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 M277-1457 available by request