Y207-5540 Screening compound: 3-(4-chlorophenyl)-11-(2-pyridyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Y207-5540 Screening compound: 3-(4-chlorophenyl)-11-(2-pyridyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Y207-5540 Screening compound: 3-(4-chlorophenyl)-11-(2-pyridyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y207-5540
3-(4-chlorophenyl)-11-(2-pyridyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

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

Y207-5540

Molecular Formula

C24H20ClN3O (C24 H20 ClN3 O)

Compound Name

3-(4-chlorophenyl)-11-(2-pyridyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

IUPAC name

14-(4-chlorophenyl)-10-(pyridin-2-yl)-29-diazatricyclo[9.4.0.0^{38}]pentadeca-1(11)357-tetraen-12-one

SMILES

O=C(CC(C1)c(cc2)ccc2Cl)C2=C1Nc(cccc1)c1NC2c1ncccc1

InChI

InChI=1S/C24H20ClN3O/c25-17-10-8-15(9-11-17)16-13-21-23(22(29)14-16)24(20-7-3-4-12-26-20)28-19-6-2-1-5-18(19)27-21/h1-12,16,24,27-28H,13-14H2

InChI Key

CTLNTZZHCZRQBJ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.9

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.734

Distribution Coefficient, logD

4.707

Water Solubility, LogSw

-5.29

Polar Surface Area

45.524

Acid Dissociation Constant (pKa)

8.59

Base Dissociation Constant (pKb)

1.24

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

16.67

Y207-5540 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y207-5540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y207-5540?
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What is the minimum amount of Y207-5540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y207-5540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y207-5540
  • 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 Y207-5540 available by request