4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine
TL;DR: 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine (CAS 1049783-76-7) is a chemical compound with molecular formula C16H16Cl2N2OS and molecular weight 354.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-(2-chlorophenothiazin-10-yl)butan-1-one;hydrochloride
Also Known As: 4-amino-1-(2-chlorophenothiazin-10-yl)butan-1-one Hydrochloride, 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine, 4-amino-1-(2-chloro-10H-phenothiazin-10-yl)butan-1-one hydrochloride
| Molecular Formula | C16H16Cl2N2OS |
|---|---|
| Molecular Weight | 354.04 g/mol |
| LogP | 4.63 |
| Topological Polar Surface Area | 46.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.03604 |
| Heavy Atoms | 22 |
| Complexity | 693.59607 |
Chemical Identifiers
| CAS Number | 1049783-76-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)C(=O)CCCN.Cl |
Product Overview
4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine (CAS 1049783-76-7), with molecular formula C16H16Cl2N2OS and molecular weight 354.04 g/mol. IUPAC: 4-amino-1-(2-chlorophenothiazin-10-yl)butan-1-one;hydrochloride.
Chemical Property Profile of 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine
Property Insights of 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine
The XLogP value of 4.63 indicates that 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.33 Ų, 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine has 1 hydrogen bond donor(s) and 3 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 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine?
The CAS number of 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine is 1049783-76-7.
What is the molecular formula of 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine?
The molecular formula of 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine is C16H16Cl2N2OS.
What is the molecular weight of 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine?
The molecular weight of 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine is 354.04 g/mol.
Where can I buy 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine?
You can request a quote for 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.