C223-0329 Screening compound: pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate

C223-0329 Screening compound: pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate
C223-0329 Screening compound: pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C223-0329
pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-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

C223-0329

Molecular Formula

C18H21F2N5O3 (C18 H21 F2 N5 O3)

Compound Name

pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-6-carboxylate

IUPAC name

pentyl 7-[4-(difluoromethoxy)phenyl]-5-methyl-4H7H-[1234]tetrazolo[15-a]pyrimidine-6-carboxylate

SMILES

CCCCCOC(C1=C(C)Nc2nnnn2C1c(cc1)ccc1OC(F)F)=O

InChI

InChI=1S/C18H21F2N5O3/c1-3-4-5-10-27-16(26)14-11(2)21-18-22-23-24-25(18)15(14)12-6-8-13(9-7-12)28-17(19)20/h6-9,15,17H,3-5,10H2,1-2H3,(H,21,22,24)/t15-/m0/s1

InChI Key

NPKBANQNYUWSLB-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD05031914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.710

Distribution Coefficient, logD

2.753

Water Solubility, LogSw

-3.67

Polar Surface Area

80.120

Acid Dissociation Constant (pKa)

6.49

Base Dissociation Constant (pKb)

-5.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.40

References: we are preparing a list of scientific research reports with C223-0329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C223-0329?
Check Price and Availability of C223-0329, 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 C223-0329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C223-0329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C223-0329
  • 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 C223-0329 available by request