Pamidronate disodium salt
TL;DR: Pamidronate disodium salt (CAS 5725-38-2) is a chemical compound with molecular formula C16H17N3O5 and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 3,4-dimethyl-6-(3-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: Pamidronate disodium salt, BAS 00714434, PROP-2-ENYL 1,6-DIMETHYL-4-(3-NITROPHENYL)-2-OXO-3,4-DIHYDROPYRIMIDINE-5-CARBOXYLATE, prop-2-en-1-yl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, prop-2-enyl 3,4-dimethyl-6-(3-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate
| Molecular Formula | C16H17N3O5 |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | 2.2941 |
| Topological Polar Surface Area | 101.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.11682 |
| Heavy Atoms | 24 |
| Complexity | 740.98334 |
Chemical Identifiers
| CAS Number | 5725-38-2 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC=C |
Product Overview
Pamidronate disodium salt (CAS 5725-38-2), with molecular formula C16H17N3O5 and molecular weight 331.12 g/mol. IUPAC: prop-2-enyl 3,4-dimethyl-6-(3-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of Pamidronate disodium salt
Property Insights of Pamidronate disodium salt
The XLogP value of 2.2941 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pamidronate disodium salt. The TPSA of 101.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Pamidronate disodium salt. Following Lipinski's Rule of Five, Pamidronate disodium salt has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pamidronate disodium salt?
The CAS number of Pamidronate disodium salt is 5725-38-2.
What is the molecular formula of Pamidronate disodium salt?
The molecular formula of Pamidronate disodium salt is C16H17N3O5.
What is the molecular weight of Pamidronate disodium salt?
The molecular weight of Pamidronate disodium salt is 331.12 g/mol.
Where can I buy Pamidronate disodium salt?
You can request a quote for Pamidronate disodium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pamidronate disodium salt?
Yes, KEHONG BIO provides custom synthesis services for Pamidronate disodium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.