3617-3050 Screening compound: N-[3-CHLORO-4-(MORPHOLIN-4-YL)PHENYL]-N-[(2-METHOXYPHENYL)METHYL]BENZAMIDE

3617-3050 Screening compound: N-[3-CHLORO-4-(MORPHOLIN-4-YL)PHENYL]-N-[(2-METHOXYPHENYL)METHYL]BENZAMIDE
3617-3050 Screening compound: N-[3-CHLORO-4-(MORPHOLIN-4-YL)PHENYL]-N-[(2-METHOXYPHENYL)METHYL]BENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3617-3050
N-[3-CHLORO-4-(MORPHOLIN-4-YL)PHENYL]-N-[(2-METHOXYPHENYL)METHYL]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

3617-3050

Molecular Formula

C25H25ClN2O3 (C25 H25 ClN2 O3)

Compound Name

N-[3-CHLORO-4-(MORPHOLIN-4-YL)PHENYL]-N-[(2-METHOXYPHENYL)METHYL]BENZAMIDE

IUPAC name

n/a

SMILES

COc1c(CN(C(c2ccccc2)=O)c(cc2)cc(Cl)c2N2CCOCC2)cccc1

InChI

InChI=1S/C25H25ClN2O3/c1-30-24-10-6-5-9-20(24)18-28(25(29)19-7-3-2-4-8-19)21-11-12-23(22(26)17-21)27-13-15-31-16-14-27/h2-12,17H,13-16,18H2,1H3

InChI Key

XACQWSLKZBSEAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02768691

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.94

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

5.012

Distribution Coefficient, logD

5.012

Water Solubility, LogSw

-5.25

Polar Surface Area

34.280

Acid Dissociation Constant (pKa)

26.53

Base Dissociation Constant (pKb)

5.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

3617-3050 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3617-3050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3617-3050?
Check Price and Availability of 3617-3050, 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 3617-3050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3617-3050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3617-3050
  • 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 3617-3050 available by request