V020-9481 Screening compound: 2-chloro-N-(4-{2-oxo-3-[(2,4,6-trimethylphenyl)methyl]-1,3-diazinan-1-yl}phenyl)benzamide

V020-9481 Screening compound: 2-chloro-N-(4-{2-oxo-3-[(2,4,6-trimethylphenyl)methyl]-1,3-diazinan-1-yl}phenyl)benzamide
V020-9481 Screening compound: 2-chloro-N-(4-{2-oxo-3-[(2,4,6-trimethylphenyl)methyl]-1,3-diazinan-1-yl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9481
2-chloro-N-(4-{2-oxo-3-[(2,4,6-trimethylphenyl)methyl]-1,3-diazinan-1-yl}phenyl)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

V020-9481

Molecular Formula

C27H28ClN3O2 (C27 H28 ClN3 O2)

Compound Name

2-chloro-N-(4-{2-oxo-3-[(2,4,6-trimethylphenyl)methyl]-1,3-diazinan-1-yl}phenyl)benzamide

IUPAC name

2-chloro-N-(4-{2-oxo-3-[(246-trimethylphenyl)methyl]-13-diazinan-1-yl}phenyl)benzamide

SMILES

Cc1cc(C)c(CN(CCCN2c(cc3)ccc3NC(c(cccc3)c3Cl)=O)C2=O)c(C)c1

InChI

InChI=1S/C27H28ClN3O2/c1-18-15-19(2)24(20(3)16-18)17-30-13-6-14-31(27(30)33)22-11-9-21(10-12-22)29-26(32)23-7-4-5-8-25(23)28/h4-5,7-12,15-16H,6,13-14,17H2,1-3H3,(H,29,32)

InChI Key

NFGNAHFYWBUVOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19930706

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.99

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.349

Distribution Coefficient, logD

6.348

Water Solubility, LogSw

-6.01

Polar Surface Area

42.888

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

1.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

References: we are preparing a list of scientific research reports with V020-9481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9481?
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What is the minimum amount of V020-9481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9481
  • 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 V020-9481 available by request