2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate
TL;DR: 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate (CAS 72412-41-0) is a chemical compound with molecular formula C19H23N5O6 and molecular weight 417.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-N-(1-benzylpyrrolidin-3-yl)-4-methoxypyrimidine-5-carboxamide;oxalic acid
Also Known As: 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate, 5-Pyrimidinecarboxamide, 2-amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-, oxalate, 2-Amino-N- -4-methoxy-5-pyrimidinecarboxamideoxalate, 2-Amino-N-(1-benzylpyrrolidin-3-yl)-4-methoxypyrimidine-5-carboxamide oxalate, Oxalic acid--N-(1-benzylpyrrolidin-3-yl)-2-imino-4-methoxy-1,2-dihydropyrimidine-5-carboximidic acid (1/1)
| Molecular Formula | C19H23N5O6 |
|---|---|
| Molecular Weight | 417.16 g/mol |
| LogP | 0.2273 |
| Topological Polar Surface Area | 167.97 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.16483 |
| Heavy Atoms | 30 |
| Complexity | 880.23865 |
Chemical Identifiers
| CAS Number | 72412-41-0 |
|---|---|
| SMILES | COC1=NC(=NC=C1C(=O)NC2CCN(C2)CC3=CC=CC=C3)N.C(=O)(C(=O)O)O |
Product Overview
2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate (CAS 72412-41-0), with molecular formula C19H23N5O6 and molecular weight 417.16 g/mol. IUPAC: 2-amino-N-(1-benzylpyrrolidin-3-yl)-4-methoxypyrimidine-5-carboxamide;oxalic acid.
Chemical Property Profile of 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate
Property Insights of 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate
The XLogP value of 0.2273 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate. The TPSA of 167.97 Ų indicates high polarity, suggesting 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate has 4 hydrogen bond donor(s) and 8 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 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate?
The CAS number of 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate is 72412-41-0.
What is the molecular formula of 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate?
The molecular formula of 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate is C19H23N5O6.
What is the molecular weight of 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate?
The molecular weight of 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate is 417.16 g/mol.
Where can I buy 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate?
You can request a quote for 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-N-(1-benzyl-3-pyrrolidinyl)-4-methoxy-5-pyrimidinecarboxamide oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.