3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate
TL;DR: 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate (CAS 65285-11-2) is a chemical compound with molecular formula C19H24N2O6S and molecular weight 408.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methanesulfonic acid;methyl 3-(2-oxo-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraen-6-yl)propanoate
Also Known As: 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate, Methanesulfonic acid--methyl 3-(6-oxo-1,2,3a,4,5,6-hexahydro-3H-indolo[3,2,1-de][1,5]naphthyridin-3-yl)propanoate (1/1), RefChem:283189
| Molecular Formula | C19H24N2O6S |
|---|---|
| Molecular Weight | 408.14 g/mol |
| LogP | 2.0416 |
| Topological Polar Surface Area | 105.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.1355 |
| Heavy Atoms | 28 |
| Complexity | 1002.8455 |
Chemical Identifiers
| CAS Number | 65285-11-2 |
|---|---|
| SMILES | COC(=O)CCN1CCC2=C3C1CCC(=O)N3C4=CC=CC=C24.CS(=O)(=O)O |
Product Overview
3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate (CAS 65285-11-2), with molecular formula C19H24N2O6S and molecular weight 408.14 g/mol. IUPAC: methanesulfonic acid;methyl 3-(2-oxo-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraen-6-yl)propanoate.
Chemical Property Profile of 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate
Property Insights of 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate
The XLogP value of 2.0416 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate. The TPSA of 105.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate. Following Lipinski's Rule of Five, 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate has 1 hydrogen bond donor(s) and 6 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 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate?
The CAS number of 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate is 65285-11-2.
What is the molecular formula of 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate?
The molecular formula of 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate is C19H24N2O6S.
What is the molecular weight of 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate?
The molecular weight of 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate is 408.14 g/mol.
Where can I buy 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate?
You can request a quote for 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 3H-Indolo(3,2,1-de)(1,5)naphthyridine-3-propanoic acid, 1,2,3a,4,5,6-hexahydro-6-oxo-, methyl ester monomethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.