Polyhydroxyethylene-bis(2-amino-1,3-diazepine)
TL;DR: Polyhydroxyethylene-bis(2-amino-1,3-diazepine) (CAS 85099-48-5) is a chemical compound with molecular formula C14H18I2N6O and molecular weight 539.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-(1,3-diazepin-2-ylideneamino)ethoxy]ethyl]-1,3-diazepin-2-imine;dihydroiodide
Also Known As: Poly-hebad, Polyhydroxyethylene-bis(2-amino-1,3-diazepine), N-[2-[2-(1,3-diazepin-2-ylideneamino)ethoxy]ethyl]-1,3-diazepin-2-imine;dihydroiodide, Ethanamine, 2,2'-oxybis(N-(2H-1,3-diazepin-2-ylidene)-, dihydriodide, Ethanamine, 2,2'-oxybis(N-(2H-1,3-diazepin-2-ylidene)-, dihydriodide)
| Molecular Formula | C14H18I2N6O |
|---|---|
| Molecular Weight | 539.96 g/mol |
| LogP | 1.0208 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 539.96313 |
| Heavy Atoms | 23 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 85099-48-5 |
|---|---|
| SMILES | C1=CC=NC(=NCCOCCN=C2N=CC=CC=N2)N=C1.I.I |
| InChIKey | KWXBCGAICMHJFG-UHFFFAOYSA-N |
Product Overview
Polyhydroxyethylene-bis(2-amino-1,3-diazepine) (CAS 85099-48-5), with molecular formula C14H18I2N6O and molecular weight 539.96 g/mol. IUPAC: N-[2-[2-(1,3-diazepin-2-ylideneamino)ethoxy]ethyl]-1,3-diazepin-2-imine;dihydroiodide.
Chemical Property Profile of Polyhydroxyethylene-bis(2-amino-1,3-diazepine)
Property Insights of Polyhydroxyethylene-bis(2-amino-1,3-diazepine)
The XLogP value of 1.0208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Polyhydroxyethylene-bis(2-amino-1,3-diazepine). The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Polyhydroxyethylene-bis(2-amino-1,3-diazepine). Following Lipinski's Rule of Five, Polyhydroxyethylene-bis(2-amino-1,3-diazepine) has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Polyhydroxyethylene-bis(2-amino-1,3-diazepine)?
The CAS number of Polyhydroxyethylene-bis(2-amino-1,3-diazepine) is 85099-48-5.
What is the molecular formula of Polyhydroxyethylene-bis(2-amino-1,3-diazepine)?
The molecular formula of Polyhydroxyethylene-bis(2-amino-1,3-diazepine) is C14H18I2N6O.
What is the molecular weight of Polyhydroxyethylene-bis(2-amino-1,3-diazepine)?
The molecular weight of Polyhydroxyethylene-bis(2-amino-1,3-diazepine) is 539.96 g/mol.
Where can I buy Polyhydroxyethylene-bis(2-amino-1,3-diazepine)?
You can request a quote for Polyhydroxyethylene-bis(2-amino-1,3-diazepine) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Polyhydroxyethylene-bis(2-amino-1,3-diazepine)?
Yes, KEHONG BIO provides custom synthesis services for Polyhydroxyethylene-bis(2-amino-1,3-diazepine) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.