RefChem:217102
TL;DR: RefChem:217102 (CAS 3776-19-0) is a chemical compound with molecular formula C12H28N9P3 and molecular weight 391.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,6,6-tetrakis(aziridin-1-yl)-2-N,2-N,2-N',2-N'-tetramethyl-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-triene-2,2-diamine
Also Known As: 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-6,6-bis(dimethylamino)-2,2,4,4-tetrakis(1-aziridinyl)-, 2,2,4,4-Tetrakis(aziridin-1-yl)-6,6-bis(N,N-dimethylamino)cyclotriphosphazene, 4,4,6,6-tetrakis(aziridin-1-yl)-2-N,2-N,2-N',2-N'-tetramethyl-1,3,5-triaza-2, 6,6-Bis(aziridin-1-yl)-4,4-bis(aziridin-1-yl)-N~2~,N~2~,N'~2~,N'~2~-tetramethyl-1,3,5,2lambda~5~,4lambda~5~,6lambda~5~-triazatriphosphinine-2,2-diamine, RefChem:217102
| Molecular Formula | C12H28N9P3 |
|---|---|
| Molecular Weight | 391.17 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.16806 |
| Heavy Atoms | 24 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 3776-19-0 |
|---|---|
| SMILES | CN(C)P1(=NP(=NP(=N1)(N2CC2)N3CC3)(N4CC4)N5CC5)N(C)C |
| InChIKey | VPHYMYNRQHFJDP-UHFFFAOYSA-N |
Product Overview
RefChem:217102 (CAS 3776-19-0), with molecular formula C12H28N9P3 and molecular weight 391.17 g/mol. IUPAC: 4,4,6,6-tetrakis(aziridin-1-yl)-2-N,2-N,2-N',2-N'-tetramethyl-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-triene-2,2-diamine.
Chemical Property Profile of RefChem:217102
Property Insights of RefChem:217102
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:217102. With a topological polar surface area (TPSA) of 55.6 Ų, RefChem:217102 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:217102 has 0 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:217102?
The CAS number of RefChem:217102 is 3776-19-0.
What is the molecular formula of RefChem:217102?
The molecular formula of RefChem:217102 is C12H28N9P3.
What is the molecular weight of RefChem:217102?
The molecular weight of RefChem:217102 is 391.17 g/mol.
Where can I buy RefChem:217102?
You can request a quote for RefChem:217102 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:217102?
Yes, KEHONG BIO provides custom synthesis services for RefChem:217102 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.