L694-0363 Screening compound: 6-({4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl}sulfonyl)-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazol-2-one

L694-0363 Screening compound: 6-({4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl}sulfonyl)-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazol-2-one
L694-0363 Screening compound: 6-({4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl}sulfonyl)-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L694-0363
6-({4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl}sulfonyl)-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazol-2-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

L694-0363

Molecular Formula

C23H27N3O6S (C23 H27 N3 O6 S)

Compound Name

6-({4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl}sulfonyl)-3-(propan-2-yl)-2,3-dihydro-1,3-benzoxazol-2-one

IUPAC name

6-({4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl}sulfonyl)-3-(propan-2-yl)-23-dihydro-13-benzoxazol-2-one

SMILES

CC(C)N(c(ccc(S(N(CC1)CCN1C(Cc(cc1)ccc1OC)=O)(=O)=O)c1)c1O1)C1=O

InChI

InChI=1S/C23H27N3O6S/c1-16(2)26-20-9-8-19(15-21(20)32-23(26)28)33(29,30)25-12-10-24(11-13-25)22(27)14-17-4-6-18(31-3)7-5-17/h4-9,15-16H,10-14H2,1-3H3

InChI Key

IFBLXMOPBDJPDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27470472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.55

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.661

Distribution Coefficient, logD

2.661

Water Solubility, LogSw

-3.27

Polar Surface Area

78.243

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

-2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with L694-0363 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L694-0363?
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What is the minimum amount of L694-0363 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L694-0363
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L694-0363
  • 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 L694-0363 available by request