HR5W5Xvc2K
TL;DR: HR5W5Xvc2K (CAS 764598-01-8) is a chemical compound with molecular formula C13H21ClN3O+ and molecular weight 270.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chlorophenyl)carbamoylamino]propyl-trimethylazanium
Also Known As: 3-[(4-chlorophenyl)carbamoylamino]propyl-trimethylazanium, 3-[[[(4-Chlorophenyl)amino]carbonyl]amino]-N,N,N-trimethyl-1-propanaminium, 1-Propanaminium, 3-[[[(4-chlorophenyl)amino]carbonyl]amino]-N,N,N-trimethyl-
| Molecular Formula | C13H21ClN3O+ |
|---|---|
| Molecular Weight | 270.14 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.13733 |
| Heavy Atoms | 18 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 764598-01-8 |
|---|---|
| SMILES | C[N+](C)(C)CCCNC(=O)NC1=CC=C(C=C1)Cl |
| InChIKey | AQWIIOQXTFGOOP-UHFFFAOYSA-O |
Product Overview
HR5W5Xvc2K (CAS 764598-01-8), with molecular formula C13H21ClN3O+ and molecular weight 270.14 g/mol. IUPAC: 3-[(4-chlorophenyl)carbamoylamino]propyl-trimethylazanium.
Chemical Property Profile of HR5W5Xvc2K
Property Insights of HR5W5Xvc2K
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for HR5W5Xvc2K. With a topological polar surface area (TPSA) of 41.1 Ų, HR5W5Xvc2K exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, HR5W5Xvc2K has 2 hydrogen bond donor(s) and 1 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 HR5W5Xvc2K?
The CAS number of HR5W5Xvc2K is 764598-01-8.
What is the molecular formula of HR5W5Xvc2K?
The molecular formula of HR5W5Xvc2K is C13H21ClN3O+.
What is the molecular weight of HR5W5Xvc2K?
The molecular weight of HR5W5Xvc2K is 270.14 g/mol.
Where can I buy HR5W5Xvc2K?
You can request a quote for HR5W5Xvc2K directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for HR5W5Xvc2K?
Yes, KEHONG BIO provides custom synthesis services for HR5W5Xvc2K and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.