A4014/0171179
TL;DR: A4014/0171179 (CAS 775292-32-5) is a chemical compound with molecular formula C19H16BrN3O and molecular weight 381.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-6'-methylspiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]-2-one
Also Known As: A4014/0171179, 5-bromo-6'-methylspiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]-2-one, 18-bromo-6-methylspiro[1,2,3,4-tetrahydrobeta-carboline-1,3'-indoline]-15-one, 5'-bromo-6-methyl-2,3,4,9-tetrahydrospiro[beta-carboline-1,3'-indol]-2'(1'H)-one, 5-bromo-6'-methyl-2',3',4',9'-tetrahydrospiro[indoline-3,1'-pyrido[3,4-b]indol]-2-one
| Molecular Formula | C19H16BrN3O |
|---|---|
| Molecular Weight | 381.05 g/mol |
| LogP | 3.58022 |
| Topological Polar Surface Area | 56.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 381.04767 |
| Heavy Atoms | 24 |
| Complexity | 1022.86896 |
Chemical Identifiers
| CAS Number | 775292-32-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C2CCNC34C5=C(C=CC(=C5)Br)NC4=O |
Product Overview
A4014/0171179 (CAS 775292-32-5), with molecular formula C19H16BrN3O and molecular weight 381.05 g/mol. IUPAC: 5-bromo-6'-methylspiro[1H-indole-3,1'-2,3,4,9-tetrahydropyrido[3,4-b]indole]-2-one.
Chemical Property Profile of A4014/0171179
Property Insights of A4014/0171179
The XLogP value of 3.58022 indicates that A4014/0171179 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.92 Ų, A4014/0171179 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A4014/0171179 has 3 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 A4014/0171179?
The CAS number of A4014/0171179 is 775292-32-5.
What is the molecular formula of A4014/0171179?
The molecular formula of A4014/0171179 is C19H16BrN3O.
What is the molecular weight of A4014/0171179?
The molecular weight of A4014/0171179 is 381.05 g/mol.
Where can I buy A4014/0171179?
You can request a quote for A4014/0171179 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4014/0171179?
Yes, KEHONG BIO provides custom synthesis services for A4014/0171179 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.