J043-0013 Screening compound: 7-(2,3,4-trimethoxyphenyl)-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of ChemDiv screening compound J043-0013
7-(2,3,4-trimethoxyphenyl)-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-5-carboxylic acid
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
J043-0013
Molecular Formula
C14H15N5O5 (C14 H15 N5 O5)
Compound Name
7-(2,3,4-trimethoxyphenyl)-4H,7H-[1,2,3,4]tetrazolo[1,5-a]pyrimidine-5-carboxylic acid
IUPAC name
7-(234-trimethoxyphenyl)-4H7H-[1234]tetrazolo[15-a]pyrimidine-5-carboxylic acid
SMILES
COc(ccc(C1n2nnnc2NC(C(O)=O)=C1)c1OC)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
333.3
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
0.784
Distribution Coefficient, logD
-2.341
Water Solubility, LogSw
-1.86
Polar Surface Area
104.821
Acid Dissociation Constant (pKa)
4.28
Base Dissociation Constant (pKb)
-1.80
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
28.60
J043-0013 in Drug Discovery
Included in Screening Libraries
RNA-Protein Interaction Inhibitors Library (1986 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with J043-0013 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)