N-bromoacetyl-2-iodo-5-methoxytryptamine
TL;DR: N-bromoacetyl-2-iodo-5-methoxytryptamine (CAS 136669-49-3) is a chemical compound with molecular formula C13H14BrIN2O2 and molecular weight 435.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl]acetamide
Also Known As: BMNEP cpd, N-BIM, N-Bromoacetyl-2-iodo-5-methoxytryptamine, 2-bromo-N-[2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl]acetamide, Acetamide,2-bromo-N-[2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl]-
| Molecular Formula | C13H14BrIN2O2 |
|---|---|
| Molecular Weight | 435.93 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 54.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 435.92834 |
| Heavy Atoms | 19 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 136669-49-3 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)NC(=C2CCNC(=O)CBr)I |
| InChIKey | VFEQIOCRTCGDMH-UHFFFAOYSA-N |
Product Overview
N-bromoacetyl-2-iodo-5-methoxytryptamine (CAS 136669-49-3), with molecular formula C13H14BrIN2O2 and molecular weight 435.93 g/mol. IUPAC: 2-bromo-N-[2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl]acetamide.
Chemical Property Profile of N-bromoacetyl-2-iodo-5-methoxytryptamine
Property Insights of N-bromoacetyl-2-iodo-5-methoxytryptamine
The XLogP value of 3.1 indicates that N-bromoacetyl-2-iodo-5-methoxytryptamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.1 Ų, N-bromoacetyl-2-iodo-5-methoxytryptamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-bromoacetyl-2-iodo-5-methoxytryptamine has 2 hydrogen bond donor(s) and 2 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 N-bromoacetyl-2-iodo-5-methoxytryptamine?
The CAS number of N-bromoacetyl-2-iodo-5-methoxytryptamine is 136669-49-3.
What is the molecular formula of N-bromoacetyl-2-iodo-5-methoxytryptamine?
The molecular formula of N-bromoacetyl-2-iodo-5-methoxytryptamine is C13H14BrIN2O2.
What is the molecular weight of N-bromoacetyl-2-iodo-5-methoxytryptamine?
The molecular weight of N-bromoacetyl-2-iodo-5-methoxytryptamine is 435.93 g/mol.
Where can I buy N-bromoacetyl-2-iodo-5-methoxytryptamine?
You can request a quote for N-bromoacetyl-2-iodo-5-methoxytryptamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-bromoacetyl-2-iodo-5-methoxytryptamine?
Yes, KEHONG BIO provides custom synthesis services for N-bromoacetyl-2-iodo-5-methoxytryptamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.