D277-0404 Screening compound: 1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-2-[(morpholin-4-yl)methyl]-1H-1,3-benzodiazole

D277-0404 Screening compound: 1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-2-[(morpholin-4-yl)methyl]-1H-1,3-benzodiazole
D277-0404 Screening compound: 1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-2-[(morpholin-4-yl)methyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D277-0404
1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-2-[(morpholin-4-yl)methyl]-1H-1,3-benzodiazole

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

D277-0404

Molecular Formula

C24H31N3O2 (C24 H31 N3 O2)

Compound Name

1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-2-[(morpholin-4-yl)methyl]-1H-1,3-benzodiazole

IUPAC name

1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-2-[(morpholin-4-yl)methyl]-1H-13-benzodiazole

SMILES

CC(C)c(ccc(C)c1)c1OCCn1c(cccc2)c2nc1CN1CCOCC1

InChI

InChI=1S/C24H31N3O2/c1-18(2)20-9-8-19(3)16-23(20)29-15-12-27-22-7-5-4-6-21(22)25-24(27)17-26-10-13-28-14-11-26/h4-9,16,18H,10-15,17H2,1-3H3

InChI Key

OSCLCYIMEWOTHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08362034

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.937

Distribution Coefficient, logD

4.936

Water Solubility, LogSw

-4.57

Polar Surface Area

30.267

Acid Dissociation Constant (pKa)

23.66

Base Dissociation Constant (pKb)

4.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.80

D277-0404 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D277-0404 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D277-0404?
Check Price and Availability of D277-0404, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D277-0404 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D277-0404
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D277-0404
  • 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 D277-0404 available by request