BAM-1110 Free
TL;DR: BAM-1110 Free (CAS 105579-47-3) is a chemical compound with molecular formula C18H21N5 and molecular weight 307.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,9R)-7-methyl-9-(1,2,4-triazol-1-ylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline
Also Known As: BAM-1110 Free, BAM 1110, (5R,8R,10R)-6-Methyl-8-(1,2,4-triazol-1-ylmethyl)ergoline, 6-Methyl-8-(1H-1,2,4-triazol-1-ylmethyl)ergoline (8-beta)-, 6-Methyl-8-[(1H-1,2,4-triazol-1-yl)methyl]ergoline
| Molecular Formula | C18H21N5 |
|---|---|
| Molecular Weight | 307.18 g/mol |
| LogP | 2.4196 |
| Topological Polar Surface Area | 49.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.1797 |
| Heavy Atoms | 23 |
| Complexity | 834.3491 |
Chemical Identifiers
| CAS Number | 105579-47-3 |
|---|---|
| SMILES | CN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CN5C=NC=N5 |
Product Overview
BAM-1110 Free (CAS 105579-47-3), with molecular formula C18H21N5 and molecular weight 307.18 g/mol. IUPAC: (6aR,9R)-7-methyl-9-(1,2,4-triazol-1-ylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline.
Chemical Property Profile of BAM-1110 Free
Property Insights of BAM-1110 Free
The XLogP value of 2.4196 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAM-1110 Free. With a topological polar surface area (TPSA) of 49.74 Ų, BAM-1110 Free exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAM-1110 Free 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 BAM-1110 Free?
The CAS number of BAM-1110 Free is 105579-47-3.
What is the molecular formula of BAM-1110 Free?
The molecular formula of BAM-1110 Free is C18H21N5.
What is the molecular weight of BAM-1110 Free?
The molecular weight of BAM-1110 Free is 307.18 g/mol.
Where can I buy BAM-1110 Free?
You can request a quote for BAM-1110 Free directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAM-1110 Free?
Yes, KEHONG BIO provides custom synthesis services for BAM-1110 Free and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.