F184-0952 Screening compound: 7-({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}sulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one

F184-0952 Screening compound: 7-({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}sulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one
F184-0952 Screening compound: 7-({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}sulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F184-0952
7-({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}sulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-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

F184-0952

Molecular Formula

C26H32N4O6S (C26 H32 N4 O6 S)

Compound Name

7-({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}sulfonyl)-6-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one

IUPAC name

7-({4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}sulfonyl)-6-methyl-34-dihydro-2H-14-benzoxazin-3-one

SMILES

Cc(cc(c(OC1)c2)NC1=O)c2S(N(CC1)CCC1C(N(CC1)CCN1c(cc1)ccc1OC)=O)(=O)=O

InChI

InChI=1S/C26H32N4O6S/c1-18-15-22-23(36-17-25(31)27-22)16-24(18)37(33,34)30-9-7-19(8-10-30)26(32)29-13-11-28(12-14-29)20-3-5-21(35-2)6-4-20/h3-6,15-16,19H,7-14,17H2,1-2H3,(H,27,31)

InChI Key

JCYVCGNTLNUVSV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14944125

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

528.63

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.116

Distribution Coefficient, logD

2.115

Water Solubility, LogSw

-3.01

Polar Surface Area

92.672

Acid Dissociation Constant (pKa)

10.30

Base Dissociation Constant (pKb)

4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

F184-0952 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F184-0952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F184-0952?
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What is the minimum amount of F184-0952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F184-0952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F184-0952
  • 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 F184-0952 available by request