K901-0927 Screening compound: 3-({7-[benzyl(2-phenylethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-ol

K901-0927 Screening compound: 3-({7-[benzyl(2-phenylethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-ol
K901-0927 Screening compound: 3-({7-[benzyl(2-phenylethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound K901-0927
3-({7-[benzyl(2-phenylethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-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

K901-0927

Molecular Formula

C24H25N5O4 (C24 H25 N5 O4)

Compound Name

3-({7-[benzyl(2-phenylethyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl}amino)propan-1-ol

IUPAC name

3-({7-[benzyl(2-phenylethyl)amino]-4-nitro-213-benzoxadiazol-5-yl}amino)propan-1-ol

SMILES

[O-][N+](c(c1nonc1c(N(CCc1ccccc1)Cc1ccccc1)c1)c1NCCCO)=O

InChI

InChI=1S/C24H25N5O4/c30-15-7-13-25-20-16-21(22-23(27-33-26-22)24(20)29(31)32)28(17-19-10-5-2-6-11-19)14-12-18-8-3-1-4-9-18/h1-6,8-11,16,25,30H,7,12-15,17H2

InChI Key

VWFMRSBXTLGDOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15112029

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.784

Distribution Coefficient, logD

4.784

Water Solubility, LogSw

-4.67

Polar Surface Area

98.605

Acid Dissociation Constant (pKa)

15.88

Base Dissociation Constant (pKb)

-1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with K901-0927 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K901-0927?
Check Price and Availability of K901-0927, 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 K901-0927 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K901-0927
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K901-0927
  • 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 K901-0927 available by request