N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine
TL;DR: N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine (CAS 836638-79-0) is a chemical compound with molecular formula C18H25N7O3 and molecular weight 387.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-benzyl-2-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-2,4,6-triamine
Also Known As: N4-BENZYL-N2-[3-(MORPHOLIN-4-YL)PROPYL]-5-NITROPYRIMIDINE-2,4,6-TRIAMINE, 4-N-benzyl-2-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-2,4,6-triamine, N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine, N4-benzyl-N2-(3-morpholinopropyl)-5-nitropyrimidine-2,4,6-triamine, [4-amino-6-(benzylamino)-5-nitro-pyrimidin-2-yl]-(3-morpholinopropyl)amine
| Molecular Formula | C18H25N7O3 |
|---|---|
| Molecular Weight | 387.20 g/mol |
| LogP | 1.7133 |
| Topological Polar Surface Area | 131.47 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 387.20187 |
| Heavy Atoms | 28 |
| Complexity | 782.2487 |
Chemical Identifiers
| CAS Number | 836638-79-0 |
|---|---|
| SMILES | C1COCCN1CCCNC2=NC(=C(C(=N2)NCC3=CC=CC=C3)[N+](=O)[O-])N |
Product Overview
N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine (CAS 836638-79-0), with molecular formula C18H25N7O3 and molecular weight 387.20 g/mol. IUPAC: 4-N-benzyl-2-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-2,4,6-triamine.
Chemical Property Profile of N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine
Property Insights of N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine
The XLogP value of 1.7133 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine. The TPSA of 131.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine has 3 hydrogen bond donor(s) and 9 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'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine?
The CAS number of N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine is 836638-79-0.
What is the molecular formula of N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine?
The molecular formula of N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine is C18H25N7O3.
What is the molecular weight of N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine?
The molecular weight of N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine is 387.20 g/mol.
Where can I buy N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine?
You can request a quote for N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for N'-Benzyl-N-(3-morpholin-4-yl-propyl)-5-nitro-pyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.