RefChem:371685
TL;DR: RefChem:371685 (CAS 3223-19-6) is a chemical compound with molecular formula C16H25N6O3P and molecular weight 380.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[2-[bis(aziridin-1-yl)phosphorylamino]pyrimidin-4-yl]piperidine-2-carboxylate
Also Known As: 1-(2-((Bis(1-aziridinyl)phosphinyl)amino)-4-pyrimidinyl)pipecolic acid ethyl ester, Pipecolic acid, 1-(2-((bis(1-aziridinyl)phosphinyl)amino)-4-pyrimidinyl)-, ethyl ester, Ethyl 1-(2-{[bis(aziridin-1-yl)phosphoryl]amino}pyrimidin-4-yl)piperidine-2-carboxylate, ethyl 1-[2-[bis(aziridin-1-yl)phosphorylamino]pyrimidin-4-yl]piperidine-2-carboxylate, RefChem:371685
| Molecular Formula | C16H25N6O3P |
|---|---|
| Molecular Weight | 380.17 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 90.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 380.17258 |
| Heavy Atoms | 26 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 3223-19-6 |
|---|---|
| SMILES | CCOC(=O)C1CCCCN1C2=NC(=NC=C2)NP(=O)(N3CC3)N4CC4 |
| InChIKey | KXXIYKGWJYRJLI-UHFFFAOYSA-N |
Product Overview
RefChem:371685 (CAS 3223-19-6), with molecular formula C16H25N6O3P and molecular weight 380.17 g/mol. IUPAC: ethyl 1-[2-[bis(aziridin-1-yl)phosphorylamino]pyrimidin-4-yl]piperidine-2-carboxylate.
Chemical Property Profile of RefChem:371685
Property Insights of RefChem:371685
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:371685. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:371685. Following Lipinski's Rule of Five, RefChem:371685 has 1 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 RefChem:371685?
The CAS number of RefChem:371685 is 3223-19-6.
What is the molecular formula of RefChem:371685?
The molecular formula of RefChem:371685 is C16H25N6O3P.
What is the molecular weight of RefChem:371685?
The molecular weight of RefChem:371685 is 380.17 g/mol.
Where can I buy RefChem:371685?
You can request a quote for RefChem:371685 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:371685?
Yes, KEHONG BIO provides custom synthesis services for RefChem:371685 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.