D430-2234 Screening compound: 1-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-3-[3-(trifluoromethyl)phenyl]urea

Chemical Structure Depiction of ChemDiv screening compound D430-2234
1-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-3-[3-(trifluoromethyl)phenyl]urea

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)

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Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

D430-2234

Molecular Formula

C₂₃H₂₃F₃N₆O₂ (C23 H23 F3 N6 O2)

Compound Name

1-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-3-[3-(trifluoromethyl)phenyl]urea

IUPAC name

1-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-3-[3-(trifluoromethyl)phenyl]urea

SMILES

Cc1nc(N2CCOCC2)cc(Nc(cc2)ccc2NC(Nc2cccc(C(F)(F)F)c2)=O)n1

InChI

InChI=1S/C23H23F3N6O2/c1-15-27-20(14-21(28-15)32-9-11-34-12-10-32)29-17-5-7-18(8-6-17)30-22(33)31-19-4-2-3-16(13-19)23(24,25)26/h2-8,13-14H,9-12H2,1H3,(H,27,28,29)(H2,30,31,33)

InChI Key

NDFABZAASSACCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14828709

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

Partition Coefficient, logP

5.579

Distribution Coefficient, logD

5.027

Water Solubility, LogSw

-5.54

Polar Surface Area

71.029

Acid Dissociation Constant (pK_a)

11.22

Base Dissociation Constant (pK_b)

7.81

Number of Chiral Centers

0.00

Percent sp³ carbon bonding

26.10

D430-2234 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Autophagy-Targeted Library (4564 compounds)

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

CNS Targets (44014 compounds)

PI3K-Targeted Library (17255 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:

Infections
Immune system
animal
Infections
Cancer
Digestive system
Respiratory tract
Nervous system
Male
Female
Cardiovascular
Skin
Metabolic
Immune system
Nervous system
Cancer
Digestive system
Respiratory tract
Otorhinolaryngologic
Male
Female
Hemic and lymphatic
Skin
Cancer
Digestive system
Male
Female
Hemic and lymphatic
Cancer
Nervous system
Male
Female
Hemic and lymphatic
Skin
Endocrine

Agro:

Agro

Targets:

Kinases
Kinases
Phosphatases

References: we are preparing a list of scientific research reports with D430-2234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D430-2234?
Check Price and Availability of D430-2234, 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 D430-2234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.

Delivery options for D430-2234
ChemDiv sends parcels with Express services (UPS, WC).

1–2 days for small orders
2–4 weeks for large selections

Delivery formats for D430-2234

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 D430-2234 available by request