3938-1611 Screening compound: 4-(4-methoxyphenyl)-N-[1-(4-methylphenyl)-1H-1,3-benzodiazol-5-yl]phthalazin-1-amine

3938-1611 Screening compound: 4-(4-methoxyphenyl)-N-[1-(4-methylphenyl)-1H-1,3-benzodiazol-5-yl]phthalazin-1-amine
3938-1611 Screening compound: 4-(4-methoxyphenyl)-N-[1-(4-methylphenyl)-1H-1,3-benzodiazol-5-yl]phthalazin-1-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3938-1611
4-(4-methoxyphenyl)-N-[1-(4-methylphenyl)-1H-1,3-benzodiazol-5-yl]phthalazin-1-amine

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

3938-1611

Molecular Formula

C29H23N5O (C29 H23 N5 O)

Compound Name

4-(4-methoxyphenyl)-N-[1-(4-methylphenyl)-1H-1,3-benzodiazol-5-yl]phthalazin-1-amine

IUPAC name

4-(4-methoxyphenyl)-N-[1-(4-methylphenyl)-1H-13-benzodiazol-5-yl]phthalazin-1-amine

SMILES

Cc(cc1)ccc1-n1c(ccc(Nc2nnc(-c(cc3)ccc3OC)c3ccccc23)c2)c2nc1

InChI

InChI=1S/C29H23N5O/c1-19-7-12-22(13-8-19)34-18-30-26-17-21(11-16-27(26)34)31-29-25-6-4-3-5-24(25)28(32-33-29)20-9-14-23(35-2)15-10-20/h3-18H,1-2H3,(H,31,33)

InChI Key

TYAZLHONVDTNKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02239007

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.239

Distribution Coefficient, logD

5.827

Water Solubility, LogSw

-5.93

Polar Surface Area

49.949

Acid Dissociation Constant (pKa)

18.69

Base Dissociation Constant (pKb)

7.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.90

3938-1611 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3938-1611 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3938-1611?
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What is the minimum amount of 3938-1611 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3938-1611
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3938-1611
  • 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 3938-1611 available by request