A2957/0124517
TL;DR: A2957/0124517 (CAS 330833-42-6) is a chemical compound with molecular formula C16H19N3O7 and molecular weight 365.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: A2957/0124517, propyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, propyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C16H19N3O7 |
|---|---|
| Molecular Weight | 365.12 g/mol |
| LogP | 1.8901 |
| Topological Polar Surface Area | 140.03 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.1223 |
| Heavy Atoms | 26 |
| Complexity | 788.2932 |
Chemical Identifiers
| CAS Number | 330833-42-6 |
|---|---|
| SMILES | CCCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C(=C2)OC)O)[N+](=O)[O-])C |
Product Overview
A2957/0124517 (CAS 330833-42-6), with molecular formula C16H19N3O7 and molecular weight 365.12 g/mol. IUPAC: propyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of A2957/0124517
Property Insights of A2957/0124517
The XLogP value of 1.8901 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2957/0124517. The TPSA of 140.03 Ų indicates high polarity, suggesting A2957/0124517 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A2957/0124517 has 3 hydrogen bond donor(s) and 7 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 A2957/0124517?
The CAS number of A2957/0124517 is 330833-42-6.
What is the molecular formula of A2957/0124517?
The molecular formula of A2957/0124517 is C16H19N3O7.
What is the molecular weight of A2957/0124517?
The molecular weight of A2957/0124517 is 365.12 g/mol.
Where can I buy A2957/0124517?
You can request a quote for A2957/0124517 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2957/0124517?
Yes, KEHONG BIO provides custom synthesis services for A2957/0124517 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.