C174-0574 Screening compound: 3,4,5-trimethoxy-N-(2-{1-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}ethyl)benzamide

C174-0574 Screening compound: 3,4,5-trimethoxy-N-(2-{1-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}ethyl)benzamide
C174-0574 Screening compound: 3,4,5-trimethoxy-N-(2-{1-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}ethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C174-0574
3,4,5-trimethoxy-N-(2-{1-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}ethyl)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

C174-0574

Molecular Formula

C27H29N3O4 (C27 H29 N3 O4)

Compound Name

3,4,5-trimethoxy-N-(2-{1-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-2-yl}ethyl)benzamide

IUPAC name

345-trimethoxy-N-(2-{1-[(2-methylphenyl)methyl]-1H-13-benzodiazol-2-yl}ethyl)benzamide

SMILES

Cc1c(Cn2c(cccc3)c3nc2CCNC(c(cc2OC)cc(OC)c2OC)=O)cccc1

InChI

InChI=1S/C27H29N3O4/c1-18-9-5-6-10-19(18)17-30-22-12-8-7-11-21(22)29-25(30)13-14-28-27(31)20-15-23(32-2)26(34-4)24(16-20)33-3/h5-12,15-16H,13-14,17H2,1-4H3,(H,28,31)

InChI Key

NLYIXDIEYQXCLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04459144

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.736

Distribution Coefficient, logD

4.734

Water Solubility, LogSw

-4.50

Polar Surface Area

58.376

Acid Dissociation Constant (pKa)

14.72

Base Dissociation Constant (pKb)

4.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

C174-0574 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with C174-0574 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C174-0574?
Check Price and Availability of C174-0574, 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 C174-0574 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C174-0574
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C174-0574
  • 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 C174-0574 available by request