3258-0079 Screening compound: 1-[bis(prop-2-en-1-yl)amino]-3-(3,6-dichloro-9H-carbazol-9-yl)propan-2-ol

3258-0079 Screening compound: 1-[bis(prop-2-en-1-yl)amino]-3-(3,6-dichloro-9H-carbazol-9-yl)propan-2-ol
3258-0079 Screening compound: 1-[bis(prop-2-en-1-yl)amino]-3-(3,6-dichloro-9H-carbazol-9-yl)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3258-0079
1-[bis(prop-2-en-1-yl)amino]-3-(3,6-dichloro-9H-carbazol-9-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

3258-0079

Molecular Formula

C21H22Cl2N2O (C21 H22 Cl2 N2 O)

Compound Name

1-[bis(prop-2-en-1-yl)amino]-3-(3,6-dichloro-9H-carbazol-9-yl)propan-2-ol

IUPAC name

1-[bis(prop-2-en-1-yl)amino]-3-(36-dichloro-9H-carbazol-9-yl)propan-2-ol

SMILES

C=CCN(CC(Cn1c(ccc(Cl)c2)c2c2c1ccc(Cl)c2)O)CC=C

InChI

InChI=1S/C21H22Cl2N2O/c1-3-9-24(10-4-2)13-17(26)14-25-20-7-5-15(22)11-18(20)19-12-16(23)6-8-21(19)25/h3-8,11-12,17,26H,1-2,9-10,13-14H2/t17-/m0/s1

InChI Key

BQSMDOYYINIQJM-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD01850285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.32

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.822

Distribution Coefficient, logD

5.478

Water Solubility, LogSw

-6.00

Polar Surface Area

21.773

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

7.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.80

3258-0079 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3258-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3258-0079?
Check Price and Availability of 3258-0079, 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 3258-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3258-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3258-0079
  • 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 3258-0079 available by request