5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine
TL;DR: 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine (CAS 102460-94-6) is a chemical compound with molecular formula C20H21N5O2 and molecular weight 363.16953 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-nitro-4-N,6-N-bis(2-phenylethyl)pyrimidine-4,6-diamine
Also Known As: 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine, 5-nitro-N4,N6-bis(2-phenylethyl)pyrimidine-4,6-diamine, 5-nitro-4-N,6-N-bis(2-phenylethyl)pyrimidine-4,6-diamine, 5-nitro-N,N'-diphenethyl-pyrimidine-4,6-diamine, 5-nitro-4-N,6-N-diphenethylpyrimidine-4,6-diamine
Technical Specifications
| Molecular Formula | C20H21N5O2 |
| Molecular Weight | 363.16953 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 95.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 363.16953 Da |
| Heavy Atoms | 27 |
| Complexity | 401.0 |
| SMILES | C1=CC=C(C=C1)CCNC2=C(C(=NC=N2)NCCC3=CC=CC=C3)[N+](=O)[O-] |
| InChIKey | JISJXMJPJRVYDC-UHFFFAOYSA-N |
Chemical Property Profile of 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine
Property Insights of 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine
The XLogP value of 5.7 indicates that 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine. Following Lipinski's Rule of Five, 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine?
The CAS number of 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine is 102460-94-6.
What is the molecular formula of 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine?
The molecular formula of 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine is C20H21N5O2.
What is the molecular weight of 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine?
The molecular weight of 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine is 363.16953 g/mol.
Where can I buy 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine?
You can request a quote for 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine?
Yes, CoreyChem provides custom synthesis services for 5-nitro-N~4~,N~6~-diphenethyl-4,6-pyrimidinediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.