N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide
TL;DR: N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide (CAS 91398-41-3) is a chemical compound with molecular formula C12H11ClN4O and molecular weight 262.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-amino-6-chloropyrimidin-5-yl)-N-benzylformamide
Also Known As: N-(4-amino-6-chloropyrimidin-5-yl)-N-benzylformamide, N-(4-AMINO-6-CHLORO-PYRIMIDIN-5-YL)-N-BENZYL-FORMAMIDE, N-<4-Amino-6-chlor-pyrimidin-5-yl>-N-benzyl-formamid, Formamide, N-(4-amino-6-chloropyrimidin-5-yl)-N-benzyl-
| Molecular Formula | C12H11ClN4O |
|---|---|
| Molecular Weight | 262.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.06213 |
| Heavy Atoms | 18 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 91398-41-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(C=O)C2=C(N=CN=C2Cl)N |
| InChIKey | CXZJQOQASZQWBV-UHFFFAOYSA-N |
Product Overview
N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide (CAS 91398-41-3), with molecular formula C12H11ClN4O and molecular weight 262.06 g/mol. IUPAC: N-(4-amino-6-chloropyrimidin-5-yl)-N-benzylformamide.
Chemical Property Profile of N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide
Property Insights of N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide. Following Lipinski's Rule of Five, N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide has 1 hydrogen bond donor(s) and 4 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 N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide?
The CAS number of N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide is 91398-41-3.
What is the molecular formula of N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide?
The molecular formula of N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide is C12H11ClN4O.
What is the molecular weight of N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide?
The molecular weight of N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide is 262.06 g/mol.
Where can I buy N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide?
You can request a quote for N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Amino-6-chloro-pyrimidin-5-YL)-N-benzyl-formamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.