V008-3411 Screening compound: ethyl 3-({4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[(1-phenylethyl)sulfamoyl]phenyl}carbamoyl)propanoate

V008-3411 Screening compound: ethyl 3-({4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[(1-phenylethyl)sulfamoyl]phenyl}carbamoyl)propanoate
V008-3411 Screening compound: ethyl 3-({4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[(1-phenylethyl)sulfamoyl]phenyl}carbamoyl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-3411
ethyl 3-({4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[(1-phenylethyl)sulfamoyl]phenyl}carbamoyl)propanoate

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

V008-3411

Molecular Formula

C31H38N4O6S (C31 H38 N4 O6 S)

Compound Name

ethyl 3-({4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[(1-phenylethyl)sulfamoyl]phenyl}carbamoyl)propanoate

IUPAC name

ethyl 3-({4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-[(1-phenylethyl)sulfamoyl]phenyl}carbamoyl)propanoate

SMILES

CCOC(CCC(Nc(cc1)cc(S(NC(C)c2ccccc2)(=O)=O)c1N(CC1)CCN1c(cccc1)c1OC)=O)=O

InChI

InChI=1S/C31H38N4O6S/c1-4-41-31(37)17-16-30(36)32-25-14-15-27(29(22-25)42(38,39)33-23(2)24-10-6-5-7-11-24)35-20-18-34(19-21-35)26-12-8-9-13-28(26)40-3/h5-15,22-23,33H,4,16-21H2,1-3H3,(H,32,36)/t23-/m0/s1

InChI Key

IXHHAQZQCIZUDA-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19972645

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

594.73

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.590

Distribution Coefficient, logD

4.589

Water Solubility, LogSw

-4.21

Polar Surface Area

98.423

Acid Dissociation Constant (pKa)

9.89

Base Dissociation Constant (pKb)

3.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.50

References: we are preparing a list of scientific research reports with V008-3411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-3411?
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What is the minimum amount of V008-3411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-3411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-3411
  • 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 V008-3411 available by request