![methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate structure](/static/products/2236/223690-87-7.webp)
methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate
TL;DR: methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate (CAS 223690-87-7) is a chemical compound with molecular formula C19H13BrN2O2 and molecular weight 380.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate
Also Known As: methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate, J1.109.910F, methyl 1-(3-bromophenyl)-9H-beta-carboline-3-carboxylate, 1-(3-Bromophenyl)-beta-carboline-3-carboxylic acid methyl ester
| Molecular Formula | C19H13BrN2O2 |
|---|---|
| Molecular Weight | 380.02 g/mol |
| LogP | 4.9322 |
| Topological Polar Surface Area | 54.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.01605 |
| Heavy Atoms | 24 |
| Complexity | 1085.3151 |
Chemical Identifiers
| CAS Number | 223690-87-7 |
|---|---|
| SMILES | COC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4=CC(=CC=C4)Br |
Product Overview
methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate (CAS 223690-87-7), with molecular formula C19H13BrN2O2 and molecular weight 380.02 g/mol. IUPAC: methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate.
Chemical Property Profile of methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate
Property Insights of methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate
The XLogP value of 4.9322 indicates that methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.98 Ų, methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate 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 methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate?
The CAS number of methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate is 223690-87-7.
What is the molecular formula of methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate?
The molecular formula of methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate is C19H13BrN2O2.
What is the molecular weight of methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate?
The molecular weight of methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate is 380.02 g/mol.
Where can I buy methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate?
You can request a quote for methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 1-(3-bromophenyl)-9H-pyrido[3,4-b]indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.