RefChem:319351
TL;DR: RefChem:319351 (CAS 72017-51-7) is a chemical compound with molecular formula C16H28BrN3O2 and molecular weight 373.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(dimethylcarbamoyloxy)-2-pyridinyl]methyl-methyl-dipropylazanium bromide
Also Known As: Ro 2-2750, Ammonium, dipropyl((3-hydroxy-2-pyridyl)methyl)methyl-, bromide, dimethylcarbamate (ester), hydrate, [3-(Dimethylcarbamoyloxy)pyridin-2-yl]methyl-methyl-dipropylazaniumbromide, [3-(dimethylcarbamoyloxy)pyridin-2-yl]methyl-methyl-dipropylazanium bromide, AMMONIUM, DIPROPYL((3-HYDROXY-2-PYRIDYL)METHYL)METHYL-, BROMIDE, DIMETHYLCARBAMA
| Molecular Formula | C16H28BrN3O2 |
|---|---|
| Molecular Weight | 373.14 g/mol |
| LogP | -0.09 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 373.1365 |
| Heavy Atoms | 22 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 72017-51-7 |
|---|---|
| SMILES | CCC[N+](C)(CCC)CC1=C(C=CC=N1)OC(=O)N(C)C.[Br-] |
| InChIKey | APWBSELWAWLPBV-UHFFFAOYSA-M |
Product Overview
RefChem:319351 (CAS 72017-51-7), with molecular formula C16H28BrN3O2 and molecular weight 373.14 g/mol. IUPAC: [3-(dimethylcarbamoyloxy)-2-pyridinyl]methyl-methyl-dipropylazanium bromide.
Chemical Property Profile of RefChem:319351
Property Insights of RefChem:319351
The XLogP value of -0.09 indicates that RefChem:319351 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.4 Ų, RefChem:319351 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319351 has 0 hydrogen bond donor(s) and 4 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:319351?
The CAS number of RefChem:319351 is 72017-51-7.
What is the molecular formula of RefChem:319351?
The molecular formula of RefChem:319351 is C16H28BrN3O2.
What is the molecular weight of RefChem:319351?
The molecular weight of RefChem:319351 is 373.14 g/mol.
Where can I buy RefChem:319351?
You can request a quote for RefChem:319351 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319351?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319351 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.