K280-0411 Screening compound: N-(3-methoxyphenyl)-2-({2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide

K280-0411 Screening compound: N-(3-methoxyphenyl)-2-({2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide
K280-0411 Screening compound: N-(3-methoxyphenyl)-2-({2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K280-0411
N-(3-methoxyphenyl)-2-({2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide

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

K280-0411

Molecular Formula

C30H29N7O2S (C30 H29 N7 O2 S)

Compound Name

N-(3-methoxyphenyl)-2-({2-[2-(2-methyl-1H-1,3-benzodiazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)butanamide

IUPAC name

N-(3-methoxyphenyl)-2-({2-[2-(2-methyl-1H-13-benzodiazol-1-yl)ethyl]-[124]triazolo[15-c]quinazolin-5-yl}sulfanyl)butanamide

SMILES

CCC(C(Nc1cc(OC)ccc1)=O)Sc1nc(cccc2)c2c2nc(CCn3c(cccc4)c4nc3C)nn12

InChI

InChI=1S/C30H29N7O2S/c1-4-26(29(38)32-20-10-9-11-21(18-20)39-3)40-30-33-23-13-6-5-12-22(23)28-34-27(35-37(28)30)16-17-36-19(2)31-24-14-7-8-15-25(24)36/h5-15,18,26H,4,16-17H2,1-3H3,(H,32,38)/t26-/m0/s1

InChI Key

XWIMKFALSJILEB-SANMLTNESA-N

MDL Number (MFCD)

MFCD15087432

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

551.67

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.841

Distribution Coefficient, logD

5.726

Water Solubility, LogSw

-5.71

Polar Surface Area

72.650

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

6.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with K280-0411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K280-0411?
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What is the minimum amount of K280-0411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K280-0411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K280-0411
  • 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 K280-0411 available by request