6213-0030 Screening compound: methyl 4-{[4-(tert-butylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate

6213-0030 Screening compound: methyl 4-{[4-(tert-butylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate
6213-0030 Screening compound: methyl 4-{[4-(tert-butylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6213-0030
methyl 4-{[4-(tert-butylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate

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

6213-0030

Molecular Formula

C17H23N5O3 (C17 H23 N5 O3)

Compound Name

methyl 4-{[4-(tert-butylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy}benzoate

IUPAC name

methyl 4-{[4-(tert-butylamino)-6-(dimethylamino)-135-triazin-2-yl]oxy}benzoate

SMILES

CC(C)(C)Nc1nc(Oc(cc2)ccc2C(OC)=O)nc(N(C)C)n1

InChI

InChI=1S/C17H23N5O3/c1-17(2,3)21-14-18-15(22(4)5)20-16(19-14)25-12-9-7-11(8-10-12)13(23)24-6/h7-10H,1-6H3,(H,18,19,20,21)

InChI Key

ZNONMEANKKGPIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05240759

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.543

Distribution Coefficient, logD

4.543

Water Solubility, LogSw

-4.40

Polar Surface Area

70.023

Acid Dissociation Constant (pKa)

17.10

Base Dissociation Constant (pKb)

3.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

References: we are preparing a list of scientific research reports with 6213-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6213-0030?
Check Price and Availability of 6213-0030, 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 6213-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6213-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6213-0030
  • 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 6213-0030 available by request