C609-0396 Screening compound: 3,4,5-trimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide

C609-0396 Screening compound: 3,4,5-trimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide
C609-0396 Screening compound: 3,4,5-trimethoxy-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 C609-0396
3,4,5-trimethoxy-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

C609-0396

Molecular Formula

C28H35N3O5S (C28 H35 N3 O5 S)

Compound Name

3,4,5-trimethoxy-N-{1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-2-yl}benzamide

IUPAC name

345-trimethoxy-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(cc1OC)cc(OC)c1OC)=O

InChI

InChI=1S/C28H35N3O5S/c1-19(29-28(32)20-17-23(34-3)27(36-5)24(18-20)35-4)26(25-7-6-16-37-25)31-14-12-30(13-15-31)21-8-10-22(33-2)11-9-21/h6-11,16-19,26H,12-15H2,1-5H3,(H,29,32)

InChI Key

XYYBPNFJZVZWQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04470873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.153

Distribution Coefficient, logD

4.152

Water Solubility, LogSw

-4.20

Polar Surface Area

61.640

Acid Dissociation Constant (pKa)

13.62

Base Dissociation Constant (pKb)

4.86

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.30

References: we are preparing a list of scientific research reports with C609-0396 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C609-0396?
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What is the minimum amount of C609-0396 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C609-0396
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C609-0396
  • 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 C609-0396 available by request