Y505-7121 Screening compound: METHYL 1-[(4'-CHLORO-1,1'',3,3''-TETRAMETHYL-1H,1'H,1''H-4,3':5',4''-TERPYRAZOL-1'-YL)METHYL]-1H-PYRAZOLE-3-CARBOXYLATE

Y505-7121 Screening compound: METHYL 1-[(4'-CHLORO-1,1'',3,3''-TETRAMETHYL-1H,1'H,1''H-4,3':5',4''-TERPYRAZOL-1'-YL)METHYL]-1H-PYRAZOLE-3-CARBOXYLATE
Y505-7121 Screening compound: METHYL 1-[(4'-CHLORO-1,1'',3,3''-TETRAMETHYL-1H,1'H,1''H-4,3':5',4''-TERPYRAZOL-1'-YL)METHYL]-1H-PYRAZOLE-3-CARBOXYLATE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y505-7121
METHYL 1-[(4'-CHLORO-1,1'',3,3''-TETRAMETHYL-1H,1'H,1''H-4,3':5',4''-TERPYRAZOL-1'-YL)METHYL]-1H-PYRAZOLE-3-CARBOXYLATE

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

Y505-7121

Molecular Formula

C19H21ClN8O2 (C19 H21 ClN8 O2)

Compound Name

METHYL 1-[(4'-CHLORO-1,1'',3,3''-TETRAMETHYL-1H,1'H,1''H-4,3':5',4''-TERPYRAZOL-1'-YL)METHYL]-1H-PYRAZOLE-3-CARBOXYLATE

IUPAC name

n/a

SMILES

Cc1nn(C)cc1-c(n(Cn(cc1)nc1C(OC)=O)nc1-c2cn(C)nc2C)c1Cl

InChI

InChI=1S/C19H21ClN8O2/c1-11-13(8-25(3)21-11)17-16(20)18(14-9-26(4)22-12(14)2)28(24-17)10-27-7-6-15(23-27)19(29)30-5/h6-9H,10H2,1-5H3

InChI Key

QNVRBZWIFHDZLP-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.904

Distribution Coefficient, logD

0.904

Water Solubility, LogSw

-2.73

Polar Surface Area

80.780

Acid Dissociation Constant (pKa)

30.15

Base Dissociation Constant (pKb)

3.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with Y505-7121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y505-7121?
Check Price and Availability of Y505-7121, 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 Y505-7121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y505-7121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y505-7121
  • 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 Y505-7121 available by request