V004-1395 Screening compound: methyl 4-{[1-(3-methoxyphenyl)-2-{4-[(2-methylphenyl)carbamoyl]piperazin-1-yl}ethoxy]methyl}benzoate

V004-1395 Screening compound: methyl 4-{[1-(3-methoxyphenyl)-2-{4-[(2-methylphenyl)carbamoyl]piperazin-1-yl}ethoxy]methyl}benzoate
V004-1395 Screening compound: methyl 4-{[1-(3-methoxyphenyl)-2-{4-[(2-methylphenyl)carbamoyl]piperazin-1-yl}ethoxy]methyl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1395
methyl 4-{[1-(3-methoxyphenyl)-2-{4-[(2-methylphenyl)carbamoyl]piperazin-1-yl}ethoxy]methyl}benzoate

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

V004-1395

Molecular Formula

C30H35N3O5 (C30 H35 N3 O5)

Compound Name

methyl 4-{[1-(3-methoxyphenyl)-2-{4-[(2-methylphenyl)carbamoyl]piperazin-1-yl}ethoxy]methyl}benzoate

IUPAC name

methyl 4-{[1-(3-methoxyphenyl)-2-{4-[(2-methylphenyl)carbamoyl]piperazin-1-yl}ethoxy]methyl}benzoate

SMILES

Cc(cccc1)c1NC(N1CCN(CC(c2cc(OC)ccc2)OCc(cc2)ccc2C(OC)=O)CC1)=O

InChI

InChI=1S/C30H35N3O5/c1-22-7-4-5-10-27(22)31-30(35)33-17-15-32(16-18-33)20-28(25-8-6-9-26(19-25)36-2)38-21-23-11-13-24(14-12-23)29(34)37-3/h4-14,19,28H,15-18,20-21H2,1-3H3,(H,31,35)/t28-/m0/s1

InChI Key

FFXCZHZTPDTJHW-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19954761

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

517.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.587

Distribution Coefficient, logD

4.550

Water Solubility, LogSw

-4.41

Polar Surface Area

64.148

Acid Dissociation Constant (pKa)

13.79

Base Dissociation Constant (pKb)

6.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V004-1395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1395?
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What is the minimum amount of V004-1395 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1395
  • 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 V004-1395 available by request