C609-0392 Screening compound: 3,4-dimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide

C609-0392 Screening compound: 3,4-dimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide
C609-0392 Screening compound: 3,4-dimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C609-0392
3,4-dimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide

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

C609-0392

Molecular Formula

C27H33N3O4S (C27 H33 N3 O4 S)

Compound Name

3,4-dimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide

IUPAC name

34-dimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide

SMILES

CC(C(c1cccs1)N(CC1)CCN1c(cc1)ccc1OC)NC(c(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C27H33N3O4S/c1-19(28-27(31)20-7-12-23(33-3)24(18-20)34-4)26(25-6-5-17-35-25)30-15-13-29(14-16-30)21-8-10-22(32-2)11-9-21/h5-12,17-19,26H,13-16H2,1-4H3,(H,28,31)

InChI Key

CDBIFHALWAKBEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04470870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.997

Distribution Coefficient, logD

3.996

Water Solubility, LogSw

-4.18

Polar Surface Area

53.923

Acid Dissociation Constant (pKa)

13.02

Base Dissociation Constant (pKb)

4.86

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

37.00

C609-0392 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C609-0392 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C609-0392?
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What is the minimum amount of C609-0392 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C609-0392
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C609-0392
  • 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 C609-0392 available by request