3-Morpholinomethyl-indol
TL;DR: 3-Morpholinomethyl-indol (CAS 53790-11-7) is a chemical compound with molecular formula C24H40Cl2N3OP and molecular weight 487.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-adamantylamino)-[bis(2-chloroethyl)amino]phosphoryl]adamantan-1-amine
Also Known As: 3-Morpholinomethyl-indol, N-[(1-adamantylamino)-[bis(2-chloroethyl)amino]phosphoryl]ad, N-[(1-adamantylamino)-[bis(2-chloroethyl)amino]phosphoryl]adamantan-1-amine, N,N-Bis(2-chloroethyl)-N',N''-ditricyclo[3.3.1.1~3,7~]decan-1-ylphosphoric triamide, N',N''-Di(adamantan-1-yl)-N,N-bis(2-chloroethyl)phosphoric triamide
| Molecular Formula | C24H40Cl2N3OP |
|---|---|
| Molecular Weight | 487.23 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 44.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 487.2286 |
| Heavy Atoms | 31 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 53790-11-7 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NP(=O)(NC45CC6CC(C4)CC(C6)C5)N(CCCl)CCCl |
| InChIKey | CQCQXXIKPKEGOE-UHFFFAOYSA-N |
Product Overview
3-Morpholinomethyl-indol (CAS 53790-11-7), with molecular formula C24H40Cl2N3OP and molecular weight 487.23 g/mol. IUPAC: N-[(1-adamantylamino)-[bis(2-chloroethyl)amino]phosphoryl]adamantan-1-amine.
Chemical Property Profile of 3-Morpholinomethyl-indol
Property Insights of 3-Morpholinomethyl-indol
The XLogP value of 5.7 indicates that 3-Morpholinomethyl-indol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.4 Ų, 3-Morpholinomethyl-indol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Morpholinomethyl-indol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Morpholinomethyl-indol?
The CAS number of 3-Morpholinomethyl-indol is 53790-11-7.
What is the molecular formula of 3-Morpholinomethyl-indol?
The molecular formula of 3-Morpholinomethyl-indol is C24H40Cl2N3OP.
What is the molecular weight of 3-Morpholinomethyl-indol?
The molecular weight of 3-Morpholinomethyl-indol is 487.23 g/mol.
Where can I buy 3-Morpholinomethyl-indol?
You can request a quote for 3-Morpholinomethyl-indol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Morpholinomethyl-indol?
Yes, KEHONG BIO provides custom synthesis services for 3-Morpholinomethyl-indol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.