2,2,2-tribromoethyl moprpholinophosphorochloridate
TL;DR: 2,2,2-tribromoethyl moprpholinophosphorochloridate (CAS 57576-50-8) is a chemical compound with molecular formula C35H35Cl2N5O2 and molecular weight 627.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(6-chloro-2-methoxyacridin-9-yl)-N-[3-[(6-chloro-2-methoxyacridin-9-yl)amino]propyl]butane-1,4-diamine
Also Known As: 2,2,2-tribromoethyl moprpholinophosphorochloridate, 1,4-Butanediamine, N-(6-chloro-2-methoxy-9-acridinyl)-N'-(3-((6-chloro-2-methoxy-9-acridinyl)amino)propyl)-, N'-(6-chloro-2-methoxyacridin-9-yl)-N-[3-[(6-chloro-2-methox, N'-(6-chloro-2-methoxyacridin-9-yl)-N-[3-[(6-chloro-2-methoxyacridin-9-yl)amino]propyl]butane-1,4-diamine, N(CCCCNCCCNc1c2ccc(Cl)cc2nc3ccc(OC)cc13)c4c5ccc(Cl)cc5nc6ccc(OC)cc46
| Molecular Formula | C35H35Cl2N5O2 |
|---|---|
| Molecular Weight | 627.22 g/mol |
| LogP | 9.2 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 627.2168 |
| Heavy Atoms | 44 |
| Complexity | 873.0 |
Chemical Identifiers
| CAS Number | 57576-50-8 |
|---|---|
| SMILES | COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCCNCCCNC4=C5C=C(C=CC5=NC6=C4C=CC(=C6)Cl)OC |
| InChIKey | NBJPDHSQVFIEFM-UHFFFAOYSA-N |
Product Overview
2,2,2-tribromoethyl moprpholinophosphorochloridate (CAS 57576-50-8), with molecular formula C35H35Cl2N5O2 and molecular weight 627.22 g/mol. IUPAC: N'-(6-chloro-2-methoxyacridin-9-yl)-N-[3-[(6-chloro-2-methoxyacridin-9-yl)amino]propyl]butane-1,4-diamine.
Chemical Property Profile of 2,2,2-tribromoethyl moprpholinophosphorochloridate
Property Insights of 2,2,2-tribromoethyl moprpholinophosphorochloridate
The XLogP value of 9.2 indicates that 2,2,2-tribromoethyl moprpholinophosphorochloridate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,2-tribromoethyl moprpholinophosphorochloridate. Following Lipinski's Rule of Five, 2,2,2-tribromoethyl moprpholinophosphorochloridate has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2,2-tribromoethyl moprpholinophosphorochloridate?
The CAS number of 2,2,2-tribromoethyl moprpholinophosphorochloridate is 57576-50-8.
What is the molecular formula of 2,2,2-tribromoethyl moprpholinophosphorochloridate?
The molecular formula of 2,2,2-tribromoethyl moprpholinophosphorochloridate is C35H35Cl2N5O2.
What is the molecular weight of 2,2,2-tribromoethyl moprpholinophosphorochloridate?
The molecular weight of 2,2,2-tribromoethyl moprpholinophosphorochloridate is 627.22 g/mol.
Where can I buy 2,2,2-tribromoethyl moprpholinophosphorochloridate?
You can request a quote for 2,2,2-tribromoethyl moprpholinophosphorochloridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-tribromoethyl moprpholinophosphorochloridate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-tribromoethyl moprpholinophosphorochloridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.