3347-6912 Screening compound: 1-(2-methyl-1H-1,3-benzodiazol-1-yl)-3-(5-methyl-2,3-diphenyl-1H-indol-1-yl)propan-2-ol

3347-6912 Screening compound: 1-(2-methyl-1H-1,3-benzodiazol-1-yl)-3-(5-methyl-2,3-diphenyl-1H-indol-1-yl)propan-2-ol
3347-6912 Screening compound: 1-(2-methyl-1H-1,3-benzodiazol-1-yl)-3-(5-methyl-2,3-diphenyl-1H-indol-1-yl)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3347-6912
1-(2-methyl-1H-1,3-benzodiazol-1-yl)-3-(5-methyl-2,3-diphenyl-1H-indol-1-yl)propan-2-ol

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

3347-6912

Molecular Formula

C32H29N3O (C32 H29 N3 O)

Compound Name

1-(2-methyl-1H-1,3-benzodiazol-1-yl)-3-(5-methyl-2,3-diphenyl-1H-indol-1-yl)propan-2-ol

IUPAC name

1-(2-methyl-1H-13-benzodiazol-1-yl)-3-(5-methyl-23-diphenyl-1H-indol-1-yl)propan-2-ol

SMILES

Cc1nc(cccc2)c2n1CC(Cn(c1c2cc(C)cc1)c(-c1ccccc1)c2-c1ccccc1)O

InChI

InChI=1S/C32H29N3O/c1-22-17-18-29-27(19-22)31(24-11-5-3-6-12-24)32(25-13-7-4-8-14-25)35(29)21-26(36)20-34-23(2)33-28-15-9-10-16-30(28)34/h3-19,26,36H,20-21H2,1-2H3/t26-/m0/s1

InChI Key

PSDRVKUJCIMHDA-SANMLTNESA-N

MDL Number (MFCD)

MFCD01816235

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

471.6

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.202

Distribution Coefficient, logD

7.199

Water Solubility, LogSw

-5.85

Polar Surface Area

27.522

Acid Dissociation Constant (pKa)

16.48

Base Dissociation Constant (pKb)

5.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.60

3347-6912 in Drug Discovery

Included in Screening Libraries

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

MCL1 Targeted Library (12200 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 3347-6912 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3347-6912?
Check Price and Availability of 3347-6912, 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 3347-6912 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3347-6912
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3347-6912
  • 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 3347-6912 available by request